N-[(3-chlorophenyl)methyl]-5-oxo-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-5-oxo-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
N-[(3-chlorophenyl)methyl]-5-oxo-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0390 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-5-oxo-1-sulfanylidene-4,5-dihydro-1H,8H-[1,3]dioxolo[4,5-g][1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 445.9 |
| Molecular Formula: | C19 H12 Cl N3 O4 S2 |
| Smiles: | C(c1cccc(c1)[Cl])NC(C1=C2NC(c3cc4c(cc3N2C(=S)S1)OCO4)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5121 |
| logD: | 3.5121 |
| logSw: | -3.9886 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.505 |
| InChI Key: | LKVJQRGDNDKBFL-UHFFFAOYSA-N |