methyl 3-(3,5-dimethylphenyl)-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(3,5-dimethylphenyl)-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate
methyl 3-(3,5-dimethylphenyl)-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0675 |
| Compound Name: | methyl 3-(3,5-dimethylphenyl)-4-oxo-2-(4-phenylpiperazin-1-yl)-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 468.56 |
| Molecular Formula: | C28 H28 N4 O3 |
| Smiles: | Cc1cc(C)cc(c1)N1C(=Nc2cc(ccc2C1=O)C(=O)OC)N1CCN(CC1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.9422 |
| logD: | 4.9405 |
| logSw: | -4.6937 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.645 |
| InChI Key: | UAFXAEFCZAQILH-UHFFFAOYSA-N |