2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-methylphenyl)methyl]acetamide
2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | F394-0223 |
| Compound Name: | 2-(3-benzyl-8-fluoro-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 454.5 |
| Molecular Formula: | C27 H23 F N4 O2 |
| Smiles: | Cc1ccc(CNC(Cn2c3C(N(Cc4ccccc4)C=Nc3c3cc(ccc23)F)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1385 |
| logD: | 4.1385 |
| logSw: | -4.2561 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.4 |
| InChI Key: | FOGQALSBZYSKLH-UHFFFAOYSA-N |