产品名称

英文名称：TAK-960

同义词

TAK-960、1137868-52-0、TAK960、TAK 960、4-((9-Cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino)-2-fluoro-5-methoxy-N-(1-methylpiperidin-4-yl)benzamide、CHEMBL2392545、3831VFM1ZB、benzamide, 4-[(9-cyclopentyl-7

产品性质

CAS编号：1137868-52-0

分子式：C27H34F3N7O3

分子量：561.61

PubChem编号：53357478

英文别名：TAK-960|1137868-52-0|TAK960|TAK 960|4-((9-Cyclopentyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino)-2-fluoro-5-methoxy-N-(1-methylpiperidin-4-yl)benzamide|CHEMBL2392545|3831VFM1ZB|benzamide, 4-[(9-cyclopentyl-7

规格或纯度：97%

英文名称：TAK-960

储存温度：-20°C储存

运输条件：超低温冰袋运输

ALogP：3.6

IUPAC Name：4-[(9-cyclopentyl-7,7-difluoro-5-methyl-6-oxo-8H-pyrimido[4,5-b][1,4]diazepin-2-yl)amino]-2-fluoro-5-methoxy-N-(1-methylpiperidin-4-yl)benzamide

INCHI：InChI=1S/C27H34F3N7O3/c1-35-10-8-16(9-11-35)32-24(38)18-12-22(40-3)20(13-19(18)28)33-26-31-14-21-23(34-26)37(17-6-4-5-7-17)15-27(29,30)25(39)36(21)2/h12-14,16-17H,4-11,15H2,1-3H3,(H,32,38)(H,31,33,34)

InChi Key：GWRSATNRNFYMDI-UHFFFAOYSA-N

Canonical SMILES：CN1CCC(CC1)NC(=O)C2=CC(=C(C=C2F)NC3=NC=C4C(=N3)N(CC(C(=O)N4C)(F)F)C5CCCC5)OC

Isomeric SMILES：CN1CCC(CC1)NC(=O)C2=CC(=C(C=C2F)NC3=NC=C4C(=N3)N(CC(C(=O)N4C)(F)F)C5CCCC5)OC

PubChem CID：53357478

溶解性：≥28.05 mg/mL in DMSO; insoluble in H2O; ≥12.3 mg/mL in EtOH

产品包装