N-(butan-2-yl)-4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
N-(butan-2-yl)-4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidine-5-carboxamide
N-(butan-2-yl)-4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V023-3798 |
| Compound Name: | N-(butan-2-yl)-4-methoxy-2-[4-(2-nitrophenyl)piperazin-1-yl]pyrimidine-5-carboxamide |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C20 H26 N6 O4 |
| Salt: | not_available |
| Smiles: | CCC(C)NC(c1cnc(nc1OC)N1CCN(CC1)c1ccccc1[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0067 |
| logD: | 3.0066 |
| logSw: | -3.4892 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.178 |
| InChI Key: | CWGWXIQCGPUDGO-AWEZNQCLSA-N |