methyl 2-(azepan-1-yl)-3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-(azepan-1-yl)-3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-(azepan-1-yl)-3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0454 |
| Compound Name: | methyl 2-(azepan-1-yl)-3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 391.47 |
| Molecular Formula: | C23 H25 N3 O3 |
| Smiles: | Cc1cccc(c1)N1C(=Nc2cc(ccc2C1=O)C(=O)OC)N1CCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.266 |
| logD: | 4.2658 |
| logSw: | -4.2713 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.716 |
| InChI Key: | AFERXDAIYUFGSQ-UHFFFAOYSA-N |