C18H13BrN2O4S2

2-[4-bromo-2-[[4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetic acid

Also Known As: Skp2 Inhibitor C1|SKPin C1|Skp2 inhibitor C1 (SKPin C1)|MDK-1699|MDK 1699; MDK1699; Skp2 inhibitor C1;SKPin C1|2-(4-bromo-2-((4-oxo-3-(pyridin-3-ylmethyl)-2-thioxothiazolidin-5-ylidene)methyl)phenoxy)acetic acid|2-(4-bromo-2-{[(5Z)-4-oxo-3-[(pyridin-3-yl)methyl]-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetic acid|2-[4-bromo-2-[(Z)-[4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetic acid|2-[4-bromo-2-[[4-oxo-3-(3-pyridylmethyl)-2-thioxo-thiazolidin-5-ylidene]methyl]phenoxy]acetic acid|2-[4-bromo-2-[[4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetic acid|4-bromo-2-{[(5Z)-4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenoxyacetic acid|4-bromo-2-{[4-oxo-3-(pyridin-3-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}phenoxyacetic acid

Molecular Formula	C18H13BrN2O4S2
Molecular Weight	463.95 g/mol
LogP	3.7089
Topological Polar Surface Area	79.73 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	463.95
Monoisotopic Mass	463.95
Heavy Atoms	27
Complexity	934.2138

Chemical Identifiers

CAS Number	432001-69-9
SMILES	C1=CC(=CN=C1)CN2C(=O)C(=CC3=C(C=CC(=C3)Br)OCC(=O)O)SC2=S