THZ1

THZ1

CAS

1604810-83-4

PubChem CID

73602827

SMILES

CN(C)C/C=C/C(=O)NC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)NC3=NC=C(C(=N3)C4=CNC5=CC=CC=C54)Cl

分子式

C31H28ClN7O2

分子量

566.065

精确分子量

565.1993

InChI

InChI=1S/C31H28ClN7O2/c1-39(2)16-6-11-28(40)35-21-14-12-20(13-15-21)30(41)36-22-7-5-8-23(17-22)37-31-34-19-26(32)29(38-31)25-18-33-27-10-4-3-9-24(25)27/h3-15,17-19,33H,16H2,1-2H3,(H,35,40)(H,36,41)(H,34,37,38)/b11-6+

InChIKey

OBJNFLYHUXWUPF-IZZDOVSWSA-N

LogP

6.3305

TPSA

115.04