4-(6-methyl-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile
Chemical Structure Depiction of
4-(6-methyl-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile
4-(6-methyl-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile
Compound characteristics
| Compound ID: | C200-7614 |
| Compound Name: | 4-(6-methyl-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile |
| Molecular Weight: | 324.36 |
| Molecular Formula: | C17 H12 N2 O3 S |
| Smiles: | Cc1ccc2c(c1)C(C(=CN2)S(c1ccc(C#N)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.612 |
| logD: | 2.61 |
| logSw: | -3.2205 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.915 |
| InChI Key: | NGZAUIFMCZOUQZ-UHFFFAOYSA-N |