N-cyclohexyl-1-ethyl-N-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Chemical Structure Depiction of
N-cyclohexyl-1-ethyl-N-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide
N-cyclohexyl-1-ethyl-N-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Compound characteristics
| Compound ID: | C519-1690 |
| Compound Name: | N-cyclohexyl-1-ethyl-N-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide |
| Molecular Weight: | 581.69 |
| Molecular Formula: | C29 H35 N5 O6 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N(C)C1CCCCC1)(=O)=O)=O)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0083 |
| logD: | 4.0083 |
| logSw: | -4.2017 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 101.503 |
| InChI Key: | KRMSOEUXPIRGFP-UHFFFAOYSA-N |