4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidine
Chemical Structure Depiction of
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidine
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidine
Compound characteristics
| Compound ID: | V004-8215 |
| Compound Name: | 4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-ethyl-6-methyl-2-(3-methylphenyl)pyrimidine |
| Molecular Weight: | 516.02 |
| Molecular Formula: | C24 H26 Cl N5 O4 S |
| Salt: | not_available |
| Smiles: | CCc1c(C)nc(c2cccc(C)c2)nc1N1CCN(CC1)S(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4087 |
| logD: | 6.2046 |
| logSw: | -6.3981 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.1 |
| InChI Key: | FPOOKSXYCYTDJX-UHFFFAOYSA-N |