(2-chlorophenyl)(4-{6-ethyl-5-[(4-methylphenyl)methyl]-2-(2-methylpropyl)pyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(2-chlorophenyl)(4-{6-ethyl-5-[(4-methylphenyl)methyl]-2-(2-methylpropyl)pyrimidin-4-yl}piperazin-1-yl)methanone
(2-chlorophenyl)(4-{6-ethyl-5-[(4-methylphenyl)methyl]-2-(2-methylpropyl)pyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V005-0102 |
| Compound Name: | (2-chlorophenyl)(4-{6-ethyl-5-[(4-methylphenyl)methyl]-2-(2-methylpropyl)pyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 491.08 |
| Molecular Formula: | C29 H35 Cl N4 O |
| Salt: | not_available |
| Smiles: | CCc1c(Cc2ccc(C)cc2)c(nc(CC(C)C)n1)N1CCN(CC1)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.9239 |
| logD: | 6.7175 |
| logSw: | -6.2756 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.636 |
| InChI Key: | BTRVNSROEQBGMG-UHFFFAOYSA-N |