N,N-diethyl-1-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Chemical Structure Depiction of
N,N-diethyl-1-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide
N,N-diethyl-1-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Compound characteristics
| Compound ID: | C519-0112 |
| Compound Name: | N,N-diethyl-1-methyl-3-[4-(4-nitrophenyl)piperazine-1-carbonyl]-4-oxo-1,4-dihydroquinoline-6-sulfonamide |
| Molecular Weight: | 527.6 |
| Molecular Formula: | C25 H29 N5 O6 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)C(C(=CN2C)C(N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1739 |
| logD: | 2.1739 |
| logSw: | -2.9933 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 99.936 |
| InChI Key: | MYPCDZDWRUINFP-UHFFFAOYSA-N |