3-(4-benzylpiperazine-1-carbonyl)-N-(2,5-dimethylphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Chemical Structure Depiction of
3-(4-benzylpiperazine-1-carbonyl)-N-(2,5-dimethylphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
3-(4-benzylpiperazine-1-carbonyl)-N-(2,5-dimethylphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Compound characteristics
| Compound ID: | K784-1350 |
| Compound Name: | 3-(4-benzylpiperazine-1-carbonyl)-N-(2,5-dimethylphenyl)-N-methyl-4-oxo-1,4-dihydroquinoline-6-sulfonamide |
| Molecular Weight: | 544.67 |
| Molecular Formula: | C30 H32 N4 O4 S |
| Smiles: | Cc1ccc(C)c(c1)N(C)S(c1ccc2c(c1)C(C(=CN2)C(N1CCN(CC1)Cc1ccccc1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4008 |
| logD: | 2.8294 |
| logSw: | -4.2129 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.067 |
| InChI Key: | XGAIASIBNZNHAK-UHFFFAOYSA-N |