methyl 2-(azepan-1-yl)-3-(3-fluoro-4-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-(azepan-1-yl)-3-(3-fluoro-4-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-(azepan-1-yl)-3-(3-fluoro-4-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0605 |
| Compound Name: | methyl 2-(azepan-1-yl)-3-(3-fluoro-4-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C23 H24 F N3 O3 |
| Smiles: | Cc1ccc(cc1F)N1C(=Nc2cc(ccc2C1=O)C(=O)OC)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.4287 |
| logD: | 4.4287 |
| logSw: | -4.3381 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.716 |
| InChI Key: | ISMKAFRXQBIPET-UHFFFAOYSA-N |