2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-fluorophenyl)benzamide
Chemical Structure Depiction of
2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-fluorophenyl)benzamide
2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-fluorophenyl)benzamide
Compound characteristics
| Compound ID: | K838-0091 |
| Compound Name: | 2-[3-(azepane-1-sulfonyl)benzamido]-N-(4-fluorophenyl)benzamide |
| Molecular Weight: | 495.57 |
| Molecular Formula: | C26 H26 F N3 O4 S |
| Smiles: | C1CCCN(CC1)S(c1cccc(c1)C(Nc1ccccc1C(Nc1ccc(cc1)F)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4832 |
| logD: | 4.4765 |
| logSw: | -4.2014 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.765 |
| InChI Key: | VSAWXMSOYQYQQL-UHFFFAOYSA-N |