4-chloro-N-{4-[6-(ethanesulfonyl)pyridazin-3-yl]phenyl}-3-nitrobenzamide
Chemical Structure Depiction of
4-chloro-N-{4-[6-(ethanesulfonyl)pyridazin-3-yl]phenyl}-3-nitrobenzamide
4-chloro-N-{4-[6-(ethanesulfonyl)pyridazin-3-yl]phenyl}-3-nitrobenzamide
Compound characteristics
| Compound ID: | F133-0100 |
| Compound Name: | 4-chloro-N-{4-[6-(ethanesulfonyl)pyridazin-3-yl]phenyl}-3-nitrobenzamide |
| Molecular Weight: | 446.87 |
| Molecular Formula: | C19 H15 Cl N4 O5 S |
| Smiles: | CCS(c1ccc(c2ccc(cc2)NC(c2ccc(c(c2)[N+]([O-])=O)[Cl])=O)nn1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0013 |
| logD: | 2.9971 |
| logSw: | -3.7434 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.693 |
| InChI Key: | CENRWISZEQIEIM-UHFFFAOYSA-N |