4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-methylphenyl)methyl]benzamide
4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-methylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | M358-0845 |
| Compound Name: | 4-{[3,5-dimethyl-4-(4-methylpiperidine-1-sulfonyl)-1H-pyrazol-1-yl]methyl}-N-[(2-methylphenyl)methyl]benzamide |
| Molecular Weight: | 494.66 |
| Molecular Formula: | C27 H34 N4 O3 S |
| Smiles: | CC1CCN(CC1)S(c1c(C)nn(Cc2ccc(cc2)C(NCc2ccccc2C)=O)c1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9691 |
| logD: | 3.9689 |
| logSw: | -3.9775 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.645 |
| InChI Key: | JTHLRQABDSSGCD-UHFFFAOYSA-N |