WARFARIN-S

37341-99-4

MFCD01657696

C19 H16 O4 . C14 H12 N4 O2 S

608.672

InChI=1S/C19H16O4.C14H12N4O2S/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;15-10-5-7-11(8-6-10)21(19,20)18-14-9-16-12-3-1-2-4-13(12)17-14/h2-10,15,21H,11H2,1H3;1-9H,15H2,(H,17,18)

InChIKey=SUVPVVDTHJRFJI-UHFFFAOYSA-N

CC(=O)CC(c1ccccc1)c2c(c3ccccc3oc2=O)O.c1ccc2c(c1)ncc(n2)NS(=O)(=O)c3ccc(cc3)N

pro_donors:1

pro_acceptors:4

XLogP3:2.0

Bulk/Fine:F