3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | Y040-2850 |
| Compound Name: | 3-{[4-(4-phenylpiperazine-1-carbonyl)cyclohexyl]methyl}quinazolin-4(3H)-one |
| Molecular Weight: | 430.55 |
| Molecular Formula: | C26 H30 N4 O2 |
| Smiles: | C1C[C@H](CC[C@@H]1C(N1CCN(CC1)c1ccccc1)=O)CN1C=Nc2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.4967 |
| logD: | 3.4966 |
| logSw: | -3.7373 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.44 |
| InChI Key: | ICFKFQAZQLROIU-UHFFFAOYSA-N |