4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
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- CAS號:
- 932737-65-0
- 英文名:
- FITM
- 英文別名:
- FITM;FITM, 10 mM in DMSO;FITM,mGluR,Metabotropic glutamate receptors,inhibit,Inhibitor;4-Fluoro-N-(4-(6-(isopropylamino)pyrimidin-4-yl)thiazol-2-yl)-N-methylbenzamide;4-Fluoro-N-[4-[6-(isopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-N-methylbenzamide;4-fluoro-N-methyl-N-[4-[6-(propan-2-ylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]benzamide;Benzamide, 4-fluoro-N-methyl-N-[4-[6-[(1-methylethyl)amino]-4-pyrimidinyl]-2-thiazolyl]-
- 中文名:
- 4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
- 中文別名:
- 化合物FITM;化合物FITM,10 MM DMSO 溶液;化合物：FITM CAS:932737-65-0;化合物:FITM CAS:932737-65-0;4-氟-N-(4-(6-(異丙基氨基)嘧啶-4-基)噻唑-2-基)-N-甲基苯甲酰胺;4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
- CBNumber:
- CB03133226
- 分子式:
- C18H18FN5OS
- 分子量:
- 371.43
- MOL File:
- 932737-65-0.mol
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4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺化學(xué)性質(zhì)
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沸點(diǎn):
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573.9±60.0 °C(Predicted)
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密度:
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1.334±0.06 g/cm3(Predicted)
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儲存條件:
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Store at -20°C
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溶解度:
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DMSO: 100mM; Ethanol: 20mM
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形態(tài):
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A crystalline solid
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酸度系數(shù)(pKa):
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3.03±0.10(Predicted)
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顏色:
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White to off-white
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4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺性質(zhì)、用途與生產(chǎn)工藝
FITM是mGlu1受體的負(fù)變構(gòu)調(diào)節(jié)劑，Ki值為2.5 nM。
FITM fits tightly into the long and narrow pocket. Most of the ligand-receptor interactions are hydrophobic with the exception of the contacts of the pyrimidine-amine group with the T815
7.38
side chain. The mGlu1 binding pocket for FITM largely corresponds to mutagenic data for the common allosteric site in mGlus and likely extends to other class C GPCRs. FITM which shows high affinity and selectivity for mGlu1 over mGlu5. FITM has the high hydrogen bonds occupancy with Thr815 and Tyr805 in dimer A and B of mGlu1 during molecular dynamics simulations. The nitrogen and hydrogen atoms of FITM form the dynamical hydrogen bonds with the hydrogen atom of Tyr805 and oxygen atom of Thr815, respectively. It indicates that there is a strong attraction interaction between FITM and allosteric sites.
The pretreatment of rats with unlabeled FITM (1 mg/kg) occupies an mGluR1 binding site of 18F-FITM by more than 99% and does not affect the input function. The K
d
(nM) and B
max
(pmol/mL) obtained by the Scatchard analyses with the multidose ligand assays are 2.1 and 36.3, respectively, for the thalamus; 2.1 and 27.5, respectively, for the hippocampus; 1.5 and 22.2, respectively, for the striatum; and 1.5 and 20.5, respectively, for the cingulate cortex with a high confidence.
18
F-FITM shows excellent pharmacokinetics, namely the dense and specific accumulation in mGlu1-positive melanomas versus mGlu1-negative hepatoma and normal tissues. Furthermore, the accumulation levels of radioactivity corresponded to the extent of tumor and to levels of mGlu1 protein expression in melanomas and melanoma metastasis.
4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
上下游產(chǎn)品信息
上游原料
下游產(chǎn)品
| 更新日期 | 產(chǎn)品編號 | 產(chǎn)品名稱 | CAS編號 | 包裝 | 價(jià)格 |
|---|
| 2026/06/05 | HY-101845 | 4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
FITM | 932737-65-0 | 1 mg | 354元 |
| 2026/06/05 | HY-101845 | 4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
FITM | 932737-65-0 | 5mg | 800元 |
4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
生產(chǎn)廠家
4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺 圖譜信息:
932737-65-0, 4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺 相關(guān)搜索:
- 抑制劑
- 化合物：FITM CAS:932737-65-0
- 化合物:FITM CAS:932737-65-0
- 化合物FITM,10 MM DMSO 溶液
- 4-氟-N-(4-(6-(異丙基氨基)嘧啶-4-基)噻唑-2-基)-N-甲基苯甲酰胺
- 化合物FITM
- 4-氟-N-[4-[6-(異丙基氨基)嘧啶-4-基]-1,3-噻唑-2-基]-N-甲基苯甲酰胺
- 932737-65-0
- FITM, 10 mM in DMSO
- 4-Fluoro-N-(4-(6-(isopropylamino)pyrimidin-4-yl)thiazol-2-yl)-N-methylbenzamide
- FITM,mGluR,Metabotropic glutamate receptors,inhibit,Inhibitor
- 4-fluoro-N-methyl-N-[4-[6-(propan-2-ylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]benzamide
- Benzamide, 4-fluoro-N-methyl-N-[4-[6-[(1-methylethyl)amino]-4-pyrimidinyl]-2-thiazolyl]-
- 4-Fluoro-N-[4-[6-(isopropylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-N-methylbenzamide
- FITM