4-[4-(methanesulfonyl)piperazin-1-yl]-6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidine
Chemical Structure Depiction of
4-[4-(methanesulfonyl)piperazin-1-yl]-6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidine
4-[4-(methanesulfonyl)piperazin-1-yl]-6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidine
Compound characteristics
| Compound ID: | V005-4419 |
| Compound Name: | 4-[4-(methanesulfonyl)piperazin-1-yl]-6-methyl-5-[(4-nitrophenyl)methyl]-2-(propan-2-yl)pyrimidine |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C20 H27 N5 O4 S |
| Salt: | not_available |
| Smiles: | CC(C)c1nc(C)c(Cc2ccc(cc2)[N+]([O-])=O)c(n1)N1CCN(CC1)S(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6154 |
| logD: | 3.4808 |
| logSw: | -3.8468 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.165 |
| InChI Key: | MNDINQCHNALVIJ-UHFFFAOYSA-N |