2627486-95-5 ((1S,3S)-3-(甲基-(7-对甲苯磺酰基-7H-吡咯并[2,3-d]嘧啶-4-基)氨基)环丁烷-1-甲酰胺,(1s,3s)-3-(methyl-(7-tosyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutane-1-carboxamide)

CAS号:
2627486-95-5
中文名称:
(1S,3S)-3-(甲基-(7-对甲苯磺酰基-7H-吡咯并[2,3-d]嘧啶-4-基)氨基)环丁烷-1-甲酰胺
英文名称:
(1s,3s)-3-(methyl-(7-tosyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclobutane-1-carboxamide
分子式:
C19H21N5O3S
分子量:
399.466742277145

(1S,3S)-3-(甲基-(7-对甲苯磺酰基-7H-吡咯并[2,3-d]嘧啶-4-基)氨基)环丁烷-1-甲酰胺(2627486-95-5)名称与标识符

名称

英文别名:
Cyclobutanecarboxamide, 3-[methyl[7-[(4-methylphenyl)sulfonyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-, cis-;Cyclobutanecarboxamide, 3-[methyl[7-[(4-methylphenyl)sulfonyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino]-, cis-;

标识符

InChIKey:
SPVIVAFMKMSURK-OKILXGFUSA-N
Inchi:
1S/C19H21N5O3S/c1-12-3-5-15(6-4-12)28(26,27)24-8-7-16-18(21-11-22-19(16)24)23(2)14-9-13(10-14)17(20)25/h3-8,11,13-14H,9-10H2,1-2H3,(H2,20,25)/t13-,14+
SMILES:
CN(C1C2C=CN(S(C3C=CC(C)=CC=3)(=O)=O)C=2N=CN=1)[C@@H]1C[C@H](C(=O)N)C1

(1S,3S)-3-(甲基-(7-对甲苯磺酰基-7H-吡咯并[2,3-d]嘧啶-4-基)氨基)环丁烷-1-甲酰胺(2627486-95-5)物化性质

实验特性

  • 沸点 : 683.630±65.00 °C(Press: 760.00 Torr)(predicted)
  • 沸点 : 683.630±65.00 °C(Press: 760.00 Torr)(predicted)
  • 酸度系数(pKa) : 16.560±0.40(predicted)
  • 酸度系数(pKa) : 16.560±0.40(predicted)
  • 密度 : 1.491±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
  • 密度 : 1.491±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)