4-{6-ethyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-{6-ethyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide
4-{6-ethyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V027-7710 |
| Compound Name: | 4-{6-ethyl-2-(2-methylpropyl)-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C24 H34 N6 O3 |
| Salt: | not_available |
| Smiles: | CCc1c(Cc2ccc(cc2)[N+]([O-])=O)c(nc(CC(C)C)n1)N1CCN(CC1)C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1122 |
| logD: | 4.9057 |
| logSw: | -4.9094 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 75.175 |
| InChI Key: | NAFIKCJSOPOWDA-UHFFFAOYSA-N |