PROPICILLIN DIBENZYLAMINE

102367-60-2

MFCD01743035

C18 H22 N2 O5 S . C14 H15 N

575.726

InChI=1S/C18H22N2O5S.C14H15N/c1-4-11(25-10-8-6-5-7-9-10)14(21)19-12-15(22)20-13(17(23)24)18(2,3)26-16(12)20;1-3-7-13(8-4-1)11-15-12-14-9-5-2-6-10-14/h5-9,11-13,16H,4H2,1-3H3,(H,19,21)(H,23,24);1-10,15H,11-12H2/t11?,12-,13+,16-;/m1./s1

InChIKey=WWCQATIYNTWSSB-CFXUUZMDSA-N

CCC(C(=O)N[C@H]1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)O)Oc3ccccc3.c1ccc(cc1)CNCc2ccccc2

pro_donors:2

pro_acceptors:7

XLogP3:2.0

Bulk/Fine:F