N-(3,4-dimethylphenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-(3,4-dimethylphenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
N-(3,4-dimethylphenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | F083-0444 |
Compound Name: | N-(3,4-dimethylphenyl)-7-methyl-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
Molecular Weight: | 395.5 |
Molecular Formula: | C20 H17 N3 O2 S2 |
Smiles: | Cc1ccc2c(c1)C(NC1=C(C(Nc3ccc(C)c(C)c3)=O)SC(N12)=S)=O |
Stereo: | ACHIRAL |
logP: | 4.3184 |
logD: | 4.3184 |
logSw: | -4.3527 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 50.067 |
InChI Key: | HUIUYCJOQKSBAX-UHFFFAOYSA-N |