6-{[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]methyl}-2-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-{[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]methyl}-2-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one
6-{[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]methyl}-2-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V020-9845 |
| Compound Name: | 6-{[4-(5-chloro-2-methoxyphenyl)piperazin-1-yl]methyl}-2-[4-(2,4-dichlorobenzoyl)piperazin-1-yl]pyrimidin-4(3H)-one |
| Molecular Weight: | 591.92 |
| Molecular Formula: | C27 H29 Cl3 N6 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1N1CCN(CC1)CC1=CC(NC(=N1)N1CCN(CC1)C(c1ccc(cc1[Cl])[Cl])=O)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7744 |
| logD: | 2.5228 |
| logSw: | -4.2181 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.141 |
| InChI Key: | XPJZFBPAPVETGU-UHFFFAOYSA-N |