4-(7-chloro-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile
Chemical Structure Depiction of
4-(7-chloro-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile
4-(7-chloro-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile
Compound characteristics
| Compound ID: | C200-7612 |
| Compound Name: | 4-(7-chloro-4-oxo-1,4-dihydroquinoline-3-sulfonyl)benzonitrile |
| Molecular Weight: | 344.77 |
| Molecular Formula: | C16 H9 Cl N2 O3 S |
| Smiles: | C1=C(C(c2ccc(cc2N1)[Cl])=O)S(c1ccc(C#N)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.956 |
| logD: | 2.856 |
| logSw: | -3.9045 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.915 |
| InChI Key: | IEVCLWZCHSTYBX-UHFFFAOYSA-N |