4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidine
Chemical Structure Depiction of
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidine
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidine
Compound characteristics
| Compound ID: | V007-1726 |
| Compound Name: | 4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidine |
| Molecular Weight: | 550.46 |
| Molecular Formula: | C24 H25 Cl2 N5 O4 S |
| Salt: | not_available |
| Smiles: | CCc1c(Cc2ccc(cc2)[Cl])c(nc(C)n1)N1CCN(CC1)S(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9306 |
| logD: | 5.821 |
| logSw: | -6.1304 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.401 |
| InChI Key: | AEDDPPIXSQIHAG-UHFFFAOYSA-N |