N-[2-(3,4-dimethoxyphenyl)ethyl]-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-[2-(3,4-dimethoxyphenyl)ethyl]-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-[2-(3,4-dimethoxyphenyl)ethyl]-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: | F083-0414 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-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: | 485.54 |
| Molecular Formula: | C22 H19 N3 O6 S2 |
| Smiles: | COc1ccc(CCNC(C2=C3NC(c4cc5c(cc4N3C(=S)S2)OCO5)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.2654 |
| logD: | 2.2654 |
| logSw: | -3.1627 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.607 |
| InChI Key: | ZUIUWLPWOIFDEX-UHFFFAOYSA-N |