N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide
Chemical Structure Depiction of
N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide
N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide
Compound characteristics
| Compound ID: | V015-5240 |
| Compound Name: | N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitro-N-propylbenzamide |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C26 H32 N6 O3 |
| Salt: | not_available |
| Smiles: | CCCN(Cc1c(C)nn(c2ccccc2)c1N1CCN(C)CC1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7397 |
| logD: | 1.8233 |
| logSw: | -4.0581 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.962 |
| InChI Key: | GXFANVWQLGSAGJ-UHFFFAOYSA-N |