4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide
Chemical Structure Depiction of
4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide
4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide
Compound characteristics
| Compound ID: | M358-0793 |
| Compound Name: | 4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-fluorophenyl)methyl]benzamide |
| Molecular Weight: | 498.62 |
| Molecular Formula: | C26 H31 F N4 O3 S |
| Smiles: | CC1CCN(CC1)S(c1c(C)nn(Cc2ccc(cc2)C(NCc2ccccc2F)=O)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4555 |
| logD: | 3.4555 |
| logSw: | -3.7503 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.645 |
| InChI Key: | VLSOYZADNSSZSI-UHFFFAOYSA-N |