1-{1-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonyl}-N-(3-methylphenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-{1-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonyl}-N-(3-methylphenyl)piperidine-4-carboxamide
1-{1-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonyl}-N-(3-methylphenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G935-1939 |
| Compound Name: | 1-{1-[2-(2,3-dihydro-1H-indol-1-yl)-2-oxoethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonyl}-N-(3-methylphenyl)piperidine-4-carboxamide |
| Molecular Weight: | 535.67 |
| Molecular Formula: | C28 H33 N5 O4 S |
| Smiles: | Cc1cccc(c1)NC(C1CCN(CC1)S(c1c(C)nn(CC(N2CCc3ccccc23)=O)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2895 |
| logD: | 2.2895 |
| logSw: | -2.8844 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.745 |
| InChI Key: | YOTSGPNFEHTRMP-UHFFFAOYSA-N |