3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]-BENZENEPROPANOIC ACID ETHYL ESTER

872171-25-0

MFCD16878700

C28H30N4O3

470.57

InChI=1S/C28H30N4O3/c1-5-35-26(33)14-13-19-9-8-12-22(15-19)32-25(17-24(31-32)28(2,3)4)30-27(34)23-16-20-10-6-7-11-21(20)18-29-23/h6-12,15-18H,5,13-14H2,1-4H3,(H,30,34)

InChIKey=NIAIRKGAJUWWSP-UHFFFAOYSA-N

C(C)OC(CCC1=CC(=CC=C1)N1N=C(C=C1NC(=O)C=1N=CC2=CC=CC=C2C1)C(C)(C)C)=O

氢键供体数量:1

氢键受体数量:7

XLogP3:6.1717

Bulk/Fine:F