CBMicro_006572

6-[(Z)-[3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2,3-dimethoxybenzoic acid

Also Known As: CBMicro_006572|BIM-0006510.P001|6-{[3-(4-ethoxyphenyl)-4-oxo-2-thioxo(1,3-thiazolidin-5-ylidene)]methyl}-2,3-d imethoxybenzoic acid|6-[(Z)-[3-(4-ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-2,3-dimethoxybenzoic acid|6-{[3-(4-ethoxyphenyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2,3-dimethoxybenzoic acid|6-{(Z)-[3-(4-Ethoxyphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl}-2,3-dimethoxybenzoic acid

Molecular Formula	C21H19NO6S2
Molecular Weight	445.06537 g/mol
LogP	4.2065
Topological Polar Surface Area	85.3 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	445.06537
Monoisotopic Mass	445.06537
Heavy Atoms	30
Complexity	1032.5372

Chemical Identifiers

CAS Number	5324-97-0
SMILES	CCOC1=CC=C(C=C1)N2C(=O)/C(=C/C3=C(C(=C(C=C3)OC)OC)C(=O)O)/SC2=S