methyl 2-(4-benzylpiperazin-1-yl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-(4-benzylpiperazin-1-yl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxylate
methyl 2-(4-benzylpiperazin-1-yl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0053 |
| Compound Name: | methyl 2-(4-benzylpiperazin-1-yl)-4-oxo-3-phenyl-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C27 H26 N4 O3 |
| Smiles: | COC(c1ccc2C(N(C(=Nc2c1)N1CCN(CC1)Cc1ccccc1)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4664 |
| logD: | 2.705 |
| logSw: | -3.7386 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.925 |
| InChI Key: | OHRNWWDWFPVUKG-UHFFFAOYSA-N |