6-(azepane-1-sulfonyl)-N-benzyl-N-methyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-benzyl-N-methyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
6-(azepane-1-sulfonyl)-N-benzyl-N-methyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-2639 |
| Compound Name: | 6-(azepane-1-sulfonyl)-N-benzyl-N-methyl-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 493.62 |
| Molecular Formula: | C27 H31 N3 O4 S |
| Smiles: | CN(Cc1ccccc1)C(C1=CN(CC=C)c2ccc(cc2C1=O)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7648 |
| logD: | 3.7648 |
| logSw: | -3.9569 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.005 |
| InChI Key: | GFQSQCWRQBRWER-UHFFFAOYSA-N |