2-(3-fluorophenyl)-1-(2,4,5-trimethylbenzene-1-sulfonyl)azepane
Chemical Structure Depiction of
2-(3-fluorophenyl)-1-(2,4,5-trimethylbenzene-1-sulfonyl)azepane
2-(3-fluorophenyl)-1-(2,4,5-trimethylbenzene-1-sulfonyl)azepane
Compound characteristics
| Compound ID: | J005-0964 |
| Compound Name: | 2-(3-fluorophenyl)-1-(2,4,5-trimethylbenzene-1-sulfonyl)azepane |
| Molecular Weight: | 375.5 |
| Molecular Formula: | C21 H26 F N O2 S |
| Smiles: | Cc1cc(C)c(cc1C)S(N1CCCCCC1c1cccc(c1)F)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8276 |
| logD: | 5.8276 |
| logSw: | -5.524 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.48 |
| InChI Key: | KVMFROHJZHQYRT-FQEVSTJZSA-N |