methyl 4-[(3-chlorophenyl)methyl]-5-oxo-3-phenyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate
Chemical Structure Depiction of
methyl 4-[(3-chlorophenyl)methyl]-5-oxo-3-phenyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate
methyl 4-[(3-chlorophenyl)methyl]-5-oxo-3-phenyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate
Compound characteristics
| Compound ID: | K233-0856 |
| Compound Name: | methyl 4-[(3-chlorophenyl)methyl]-5-oxo-3-phenyl-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate |
| Molecular Weight: | 493 |
| Molecular Formula: | C25 H17 Cl N2 O3 S2 |
| Smiles: | COC(c1ccc2C(N(Cc3cccc(c3)[Cl])C3=C(c4ccccc4)SC(N3c2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2524 |
| logD: | 6.2524 |
| logSw: | -6.0067 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 38.962 |
| InChI Key: | WHZPWPJXCDONQF-UHFFFAOYSA-N |