4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-cyclooctylbenzamide
Chemical Structure Depiction of
4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-cyclooctylbenzamide
4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-cyclooctylbenzamide
Compound characteristics
| Compound ID: | C382-0316 |
| Compound Name: | 4-{[(4-bromobenzene-1-sulfonyl)amino]methyl}-N-cyclooctylbenzamide |
| Molecular Weight: | 479.44 |
| Molecular Formula: | C22 H27 Br N2 O3 S |
| Smiles: | C1CCCC(CCC1)NC(c1ccc(CNS(c2ccc(cc2)[Br])(=O)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5495 |
| logD: | 5.5493 |
| logSw: | -5.7982 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.466 |
| InChI Key: | KPPUSRIKPXCYBZ-UHFFFAOYSA-N |