ethyl 4-[6-(azepane-1-sulfonyl)-1-methyl-4-oxo-1,4-dihydroquinoline-3-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[6-(azepane-1-sulfonyl)-1-methyl-4-oxo-1,4-dihydroquinoline-3-carbonyl]piperazine-1-carboxylate
ethyl 4-[6-(azepane-1-sulfonyl)-1-methyl-4-oxo-1,4-dihydroquinoline-3-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C519-0530 |
| Compound Name: | ethyl 4-[6-(azepane-1-sulfonyl)-1-methyl-4-oxo-1,4-dihydroquinoline-3-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 504.6 |
| Molecular Formula: | C24 H32 N4 O6 S |
| Smiles: | CCOC(N1CCN(CC1)C(C1=CN(C)c2ccc(cc2C1=O)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6981 |
| logD: | 1.6981 |
| logSw: | -2.8902 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 87.02 |
| InChI Key: | VRYBXCJMGCNHFM-UHFFFAOYSA-N |