N-(3-methoxypropyl)-N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide
Chemical Structure Depiction of
N-(3-methoxypropyl)-N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide
N-(3-methoxypropyl)-N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | V020-7664 |
| Compound Name: | N-(3-methoxypropyl)-N-{[3-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1H-pyrazol-4-yl]methyl}-3-nitrobenzamide |
| Molecular Weight: | 506.6 |
| Molecular Formula: | C27 H34 N6 O4 |
| Salt: | not_available |
| Smiles: | Cc1c(CN(CCCOC)C(c2cccc(c2)[N+]([O-])=O)=O)c(N2CCN(C)CC2)n(c2ccccc2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2019 |
| logD: | 1.2855 |
| logSw: | -3.4937 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.305 |
| InChI Key: | HLXDDSXAXXOTKJ-UHFFFAOYSA-N |