N~8~-[2-(4-ethoxyphenyl)ethyl]-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
Chemical Structure Depiction of
N~8~-[2-(4-ethoxyphenyl)ethyl]-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
N~8~-[2-(4-ethoxyphenyl)ethyl]-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
Compound characteristics
| Compound ID: | K233-0928 |
| Compound Name: | N~8~-[2-(4-ethoxyphenyl)ethyl]-5-oxo-N~3~-(propan-2-yl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide |
| Molecular Weight: | 510.63 |
| Molecular Formula: | C25 H26 N4 O4 S2 |
| Smiles: | CCOc1ccc(CCNC(c2ccc3C(NC4=C(C(NC(C)C)=O)SC(N4c3c2)=S)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.8552 |
| logD: | 2.8551 |
| logSw: | -3.618 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.014 |
| InChI Key: | HMYROYDAOFGJIK-UHFFFAOYSA-N |