6-(azepane-1-sulfonyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
6-(azepane-1-sulfonyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | K788-5970 |
| Compound Name: | 6-(azepane-1-sulfonyl)-N-[(1-ethylpyrrolidin-2-yl)methyl]-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C26 H36 N4 O4 S |
| Smiles: | CCN1CCCC1CNC(C1=CN(CC=C)c2ccc(cc2C1=O)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6184 |
| logD: | 1.2528 |
| logSw: | -3.3064 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.174 |
| InChI Key: | LHJJOSHEOWODBL-HXUWFJFHSA-N |