2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V020-9876 |
| Compound Name: | 2-{4-[(3-chlorophenyl)methyl]piperazin-1-yl}-6-[(4-cyclohexylpiperazin-1-yl)methyl]pyrimidin-4(3H)-one |
| Molecular Weight: | 485.07 |
| Molecular Formula: | C26 H37 Cl N6 O |
| Smiles: | C1CCC(CC1)N1CCN(CC1)CC1=CC(NC(=N1)N1CCN(CC1)Cc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.1462 |
| logD: | 1.7396 |
| logSw: | -3.5151 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.729 |
| InChI Key: | LCUVMNDRMFSCBO-UHFFFAOYSA-N |