5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Chemical Structure Depiction of
5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine
Compound characteristics
| Compound ID: | V030-9337 |
| Compound Name: | 5-[(4-chlorophenyl)methyl]-2,4-dimethyl-6-[4-(4-nitrobenzene-1-sulfonyl)piperazin-1-yl]pyrimidine |
| Molecular Weight: | 501.99 |
| Molecular Formula: | C23 H24 Cl N5 O4 S |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccc(cc2)[Cl])c(nc(C)n1)N1CCN(CC1)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8856 |
| logD: | 4.7966 |
| logSw: | -4.9592 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.014 |
| InChI Key: | XCGGTZHXIJTMKL-UHFFFAOYSA-N |