4-{2-cyclopropyl-6-methyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide
Chemical Structure Depiction of
4-{2-cyclopropyl-6-methyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide
4-{2-cyclopropyl-6-methyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide
Compound characteristics
| Compound ID: | V005-4465 |
| Compound Name: | 4-{2-cyclopropyl-6-methyl-5-[(4-nitrophenyl)methyl]pyrimidin-4-yl}-N,N-dimethylpiperazine-1-carboxamide |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C22 H28 N6 O3 |
| Salt: | not_available |
| Smiles: | Cc1c(Cc2ccc(cc2)[N+]([O-])=O)c(nc(C2CC2)n1)N1CCN(CC1)C(N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0306 |
| logD: | 3.0368 |
| logSw: | -4.205 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.748 |
| InChI Key: | RDMQSHOUHWEDJY-UHFFFAOYSA-N |