N-({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-4-nitro-N-(propan-2-yl)benzamide
Chemical Structure Depiction of
N-({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-4-nitro-N-(propan-2-yl)benzamide
N-({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-4-nitro-N-(propan-2-yl)benzamide
Compound characteristics
| Compound ID: | V015-3163 |
| Compound Name: | N-({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)-4-nitro-N-(propan-2-yl)benzamide |
| Molecular Weight: | 522.62 |
| Molecular Formula: | C28 H35 F N6 O3 |
| Salt: | not_available |
| Smiles: | CC(C)N1CCN(CC1)c1c(CN(C(C)C)C(c2ccc(cc2)[N+]([O-])=O)=O)c(C)nn1c1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 5.0663 |
| logD: | 2.6373 |
| logSw: | -4.8307 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.115 |
| InChI Key: | BEPHYCXYFBOVDU-UHFFFAOYSA-N |