4-ethyl-N-(3-fluoro-4-methylphenyl)-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide
Chemical Structure Depiction of
4-ethyl-N-(3-fluoro-4-methylphenyl)-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide
4-ethyl-N-(3-fluoro-4-methylphenyl)-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide
Compound characteristics
| Compound ID: | S411-0095 |
| Compound Name: | 4-ethyl-N-(3-fluoro-4-methylphenyl)-9-oxo-1,2,3,3a,4,9-hexahydropyrrolo[2,1-b]quinazoline-6-carboxamide |
| Molecular Weight: | 367.42 |
| Molecular Formula: | C21 H22 F N3 O2 |
| Smiles: | CCN1C2CCCN2C(c2ccc(cc12)C(Nc1ccc(C)c(c1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5629 |
| logD: | 3.5626 |
| logSw: | -3.7834 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.704 |
| InChI Key: | WLYVTYRQRHTWCW-LJQANCHMSA-N |