methyl 2-(4-cyclohexylpiperazin-1-yl)-3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Chemical Structure Depiction of
methyl 2-(4-cyclohexylpiperazin-1-yl)-3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
methyl 2-(4-cyclohexylpiperazin-1-yl)-3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate
Compound characteristics
| Compound ID: | M124-0985 |
| Compound Name: | methyl 2-(4-cyclohexylpiperazin-1-yl)-3-[(4-fluorophenyl)methyl]-4-oxo-3,4-dihydroquinazoline-7-carboxylate |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C27 H31 F N4 O3 |
| Smiles: | COC(c1ccc2C(N(Cc3ccc(cc3)F)C(=Nc2c1)N1CCN(CC1)C1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5491 |
| logD: | 2.3668 |
| logSw: | -4.313 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.09 |
| InChI Key: | SPZOHZNXLDQNAP-UHFFFAOYSA-N |