ethyl {2-[(4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carbonyl)amino]-1,3-thiazol-4-yl}acetate
Chemical Structure Depiction of
ethyl {2-[(4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carbonyl)amino]-1,3-thiazol-4-yl}acetate
ethyl {2-[(4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carbonyl)amino]-1,3-thiazol-4-yl}acetate
Compound characteristics
| Compound ID: | Y042-4483 |
| Compound Name: | ethyl {2-[(4-ethyl-1,5-dioxo-2,3,4,5-tetrahydropyrrolo[1,2-a]quinazoline-3a(1H)-carbonyl)amino]-1,3-thiazol-4-yl}acetate |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C21 H22 N4 O5 S |
| Smiles: | CCN1C(c2ccccc2N2C(CCC12C(Nc1nc(CC(=O)OCC)cs1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1006 |
| logD: | 2.0834 |
| logSw: | -3.0531 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.899 |
| InChI Key: | IDNPKGLRRAUUEQ-OAQYLSRUSA-N |