(4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)(3,4-dichlorophenyl)methanone
Chemical Structure Depiction of
(4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)(3,4-dichlorophenyl)methanone
(4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)(3,4-dichlorophenyl)methanone
Compound characteristics
| Compound ID: | V002-3896 |
| Compound Name: | (4-{5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl}piperazin-1-yl)(3,4-dichlorophenyl)methanone |
| Molecular Weight: | 503.86 |
| Molecular Formula: | C25 H25 Cl3 N4 O |
| Smiles: | CCc1c(Cc2ccc(cc2)[Cl])c(nc(C)n1)N1CCN(CC1)C(c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4218 |
| logD: | 6.3121 |
| logSw: | -6.3926 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 39.258 |
| InChI Key: | ZJGUVLDAXKQGIC-UHFFFAOYSA-N |