methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate
methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-1017 |
| Compound Name: | methyl 3-[(4-methylphenyl)methyl]-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C28 H28 N4 O3 |
| Smiles: | Cc1ccc(CN2C(=Nc3cc(ccc3C2=O)C(=O)OC)N2CCN(CC2)c2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9216 |
| logD: | 4.9155 |
| logSw: | -4.6309 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 53.257 |
| InChI Key: | CBMWHLAORWYQSJ-UHFFFAOYSA-N |