N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-{[1-(methanesulfonyl)piperidin-4-yl]methyl}-N-methylbenzamide
Chemical Structure Depiction of
N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-{[1-(methanesulfonyl)piperidin-4-yl]methyl}-N-methylbenzamide
N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-{[1-(methanesulfonyl)piperidin-4-yl]methyl}-N-methylbenzamide
Compound characteristics
| Compound ID: | S690-2057 |
| Compound Name: | N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]-4-{[1-(methanesulfonyl)piperidin-4-yl]methyl}-N-methylbenzamide |
| Molecular Weight: | 432.58 |
| Molecular Formula: | C22 H32 N4 O3 S |
| Smiles: | CCn1cc(CN(C)C(c2ccc(CC3CCN(CC3)S(C)(=O)=O)cc2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.0551 |
| logD: | 2.0551 |
| logSw: | -2.4527 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.447 |
| InChI Key: | KRAMXVXMDLQCIP-UHFFFAOYSA-N |