188416-35-5
中文名稱
(2R,3S/2S,3R)-3-(6-氯-5-氟嘧啶-4-基)-2-(2,4-二氟苯基)-1-(1H-1,2,4-三唑-1-基)-2-丁醇鹽酸鹽
英文名稱
(2R,3S/2S,3R)-3-(4-Chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)butan-2-ol hydrochloride
CAS
188416-35-5
分子式
C16H13ClF3N5O
MDL 編號
MFCD07772028
分子量
383.76
MOL 文件
188416-35-5.mol
更新日期
2026/02/24 11:11:08
188416-35-5 結構式
基本信息
中文別名
(2R,3S/2S,3R)-3-(6-氯-5-氟嘧啶-4-基)-2-(2,4-二氟苯基)-1-(1H-1,2,4-三唑-1-基)-2-丁醇鹽酸鹽2S,3R)-3-(6-氯-5-氟嘧啶-4-基)-2-(2,4-二氟苯基)-1-(1H-1,2,4-三唑-1-基)-2-丁醇鹽酸鹽
伏立康唑中間體一
英文別名
(2R,3S/2S,3R)-3-(4-CHLORO-5-FLUORO-6-PYRIMIDINYL)-2-(2,4-DIFLUOROPHENYL)-1-(1H-1,2,4-TRIAZOL-1-YL)-2-BUTANOL HCL(2R,3S/2S,3R)-3-(4-CHLORO-5-FLUORO-6-PYRIMIDINYL)-2-(2,4-DIFLUOROPHENYL)-1-(1H-1,2,4-TRIAZOL-1-YL)-2-BUTANOL HYDROCHLORIDE
(2R,3S/2S,3R)-3-(4-Chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)butan-2-ol hydrochloride
N-2
(2R,3S/2S,3R)-3-(4-Chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)-1- (1H-
(2r,3s/2s,3r)-3-(4-Chloro-5-Fluoro-6-Pyrimidinyl)-2-(2,4-Difluorophenyl)-1-(1h-1,2,4-Triazol- 1-Yl)-2- Butanol Hydrochloride
(2R,3S/2S,3R)-3-(6-Chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol- 1-yl)-2- butanol hydrochloride
(2R,3S/2S,3R)-3-(4-CHLORO-5-FLUORO-6-PYRIMIDINYL)-2-(2,4-DIFLUOROPHENYL)-1-(1H-1,2,4-TRIAZOL-1-YL)-2-BUTANOL HCL
(2R,3S/2S,3R)-3-(6-Chloro-5-fluoropyrimidin-4-yl)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)-2-butanolhydrochlo
(2R,3S/2S,3R)-3-(4-Chloro-5-fluoro-6-pyrimidinyl)-2-(2,4-difluorophenyl)-1- (1H-1,2,4-triazol-1-yl)-2-butanol hydrochloride ( N-2 step)
(2R,3S/2S,3R)-3-(4-chloro-5-fluoro-6-pyrimidinyl)-2- (2,4-difluorophenyl)-1-(1H-1,2,4-trazol-1-yl)-2-butanol hydrochloride ( For Voriconazole )
(2R,3S/2S,3R)-3-(4-CHLORO-5-FLUORO-6-PYRIMIDINYL)-2-(2,4-DIFLUOROPHENYL)
(2R,3S/2S,3R)-3-(4-Chloro-5-fluoro-6-pyrimidinyl)-
物理化學性質
熔點183-187°C
沸點529.9±60.0 °C(Predicted)
密度1.51
儲存條件Refrigerator
溶解度DMSO (Slightly), Methanol (Slightly)
酸度系數(pKa)11.44±0.29(Predicted)
形態(tài)Solid
顏色Off-White
InChIInChI=1S/C16H13ClF3N5O/c1-9(14-13(20)15(17)23-7-22-14)16(26,5-25-8-21-6-24-25)11-3-2-10(18)4-12(11)19/h2-4,6-9,26H,5H2,1H3
InChIKeyBQDLXFABVRRDFU-UHFFFAOYSA-N
SMILESC(O)(CN1C=NC=N1)(C(C)C1N=CN=C(Cl)C=1F)C1C=CC(F)=CC=1F