1-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-2(1H)-one
Chemical Structure Depiction of
1-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-2(1H)-one
1-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-2(1H)-one
Compound characteristics
| Compound ID: | G853-0185 |
| Compound Name: | 1-[2-(azepan-1-yl)-2-oxoethyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-2(1H)-one |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C23 H31 N3 O4 S |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(C=CC(N2CC(N2CCCCCC2)=O)=O)c1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9168 |
| logD: | 2.9168 |
| logSw: | -3.6265 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.053 |
| InChI Key: | ICRUCZDXMSZHSI-UHFFFAOYSA-N |