methyl 3-(3,5-dimethylphenyl)-4-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 3-(3,5-dimethylphenyl)-4-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]-3,4-dihydroquinazoline-7-carboxylate
methyl 3-(3,5-dimethylphenyl)-4-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0707 |
| Compound Name: | methyl 3-(3,5-dimethylphenyl)-4-oxo-2-[4-(prop-2-en-1-yl)piperazin-1-yl]-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 432.52 |
| Molecular Formula: | C25 H28 N4 O3 |
| Smiles: | Cc1cc(C)cc(c1)N1C(=Nc2cc(ccc2C1=O)C(=O)OC)N1CCN(CC1)CC=C |
| Stereo: | ACHIRAL |
| logP: | 3.7263 |
| logD: | 2.5784 |
| logSw: | -3.968 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.175 |
| InChI Key: | VDBYMNLWOGJMDR-UHFFFAOYSA-N |