N-[2-(4-chlorophenyl)ethyl]-7,8-dimethoxy-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-7,8-dimethoxy-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
N-[2-(4-chlorophenyl)ethyl]-7,8-dimethoxy-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0355 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-7,8-dimethoxy-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 475.97 |
| Molecular Formula: | C21 H18 Cl N3 O4 S2 |
| Smiles: | COc1cc2C(NC3=C(C(NCCc4ccc(cc4)[Cl])=O)SC(N3c2cc1OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0306 |
| logD: | 3.0306 |
| logSw: | -3.6281 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.492 |
| InChI Key: | WVLODFLQAXKUNO-UHFFFAOYSA-N |