4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-2,6-dimethylpyrimidine
Chemical Structure Depiction of
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-2,6-dimethylpyrimidine
4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-2,6-dimethylpyrimidine
Compound characteristics
| Compound ID: | V011-8385 |
| Compound Name: | 4-[4-(4-chloro-3-nitrobenzene-1-sulfonyl)piperazin-1-yl]-5-[(2-fluorophenyl)methyl]-2,6-dimethylpyrimidine |
| Molecular Weight: | 519.98 |
| Molecular Formula: | C23 H23 Cl F N5 O4 S |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccccc2F)c(nc(C)n1)N1CCN(CC1)S(c1ccc(c(c1)[N+]([O-])=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0111 |
| logD: | 4.9822 |
| logSw: | -5.2469 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 86.713 |
| InChI Key: | WAKXUGLJNLYIMA-UHFFFAOYSA-N |