N~8~-[2-(diethylamino)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-(diethylamino)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-(diethylamino)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: | K233-0863 |
| Compound Name: | N~8~-[2-(diethylamino)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: | 461.6 |
| Molecular Formula: | C21 H27 N5 O3 S2 |
| Smiles: | CCN(CC)CCNC(c1ccc2C(NC3=C(C(NC(C)C)=O)SC(N3c2c1)=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7689 |
| logD: | 0.655 |
| logSw: | -2.7236 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.573 |
| InChI Key: | CTRHQQFVHPFYNA-UHFFFAOYSA-N |