3-(azepane-1-carbonyl)-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
3-(azepane-1-carbonyl)-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one
3-(azepane-1-carbonyl)-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | K784-9869 |
| Compound Name: | 3-(azepane-1-carbonyl)-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one |
| Molecular Weight: | 431.55 |
| Molecular Formula: | C22 H29 N3 O4 S |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)C(C(=CN2)C(N1CCCCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1894 |
| logD: | 1.1709 |
| logSw: | -3.7053 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.048 |
| InChI Key: | VJPAERNCCYZUGR-UHFFFAOYSA-N |