1-(2,3-dihydro-1H-indol-1-yl)-2-{3,5-dimethyl-4-[3-(4-methylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}ethan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-2-{3,5-dimethyl-4-[3-(4-methylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}ethan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-2-{3,5-dimethyl-4-[3-(4-methylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | G935-3889 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-2-{3,5-dimethyl-4-[3-(4-methylpiperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}ethan-1-one |
| Molecular Weight: | 527.69 |
| Molecular Formula: | C27 H37 N5 O4 S |
| Smiles: | CC1CCN(CC1)C(C1CCCN(C1)S(c1c(C)nn(CC(N2CCc3ccccc23)=O)c1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7242 |
| logD: | 1.7242 |
| logSw: | -2.4662 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 78.236 |
| InChI Key: | VQMNKQXLXOFNGP-QHCPKHFHSA-N |