(2-chlorophenyl)(4-{2,6-dimethyl-5-[(2-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
Chemical Structure Depiction of
(2-chlorophenyl)(4-{2,6-dimethyl-5-[(2-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
(2-chlorophenyl)(4-{2,6-dimethyl-5-[(2-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | V004-9611 |
| Compound Name: | (2-chlorophenyl)(4-{2,6-dimethyl-5-[(2-nitrophenyl)methyl]pyrimidin-4-yl}piperazin-1-yl)methanone |
| Molecular Weight: | 465.94 |
| Molecular Formula: | C24 H24 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2[N+]([O-])=O)c(nc(C)n1)N1CCN(CC1)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5279 |
| logD: | 4.4389 |
| logSw: | -4.6429 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.65 |
| InChI Key: | PAVGAKANVOXFMD-UHFFFAOYSA-N |