5-oxo-N~3~-[(oxolan-2-yl)methyl]-N~8~-(2-phenylethyl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
Chemical Structure Depiction of
5-oxo-N~3~-[(oxolan-2-yl)methyl]-N~8~-(2-phenylethyl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
5-oxo-N~3~-[(oxolan-2-yl)methyl]-N~8~-(2-phenylethyl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide
Compound characteristics
| Compound ID: | K233-0278 |
| Compound Name: | 5-oxo-N~3~-[(oxolan-2-yl)methyl]-N~8~-(2-phenylethyl)-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3,8-dicarboxamide |
| Molecular Weight: | 508.62 |
| Molecular Formula: | C25 H24 N4 O4 S2 |
| Smiles: | C1CC(CNC(C2=C3NC(c4ccc(cc4N3C(=S)S2)C(NCCc2ccccc2)=O)=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8564 |
| logD: | 1.8563 |
| logSw: | -2.9403 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.299 |
| InChI Key: | MECXGYRSDFGDBY-QGZVFWFLSA-N |