5-{[N-(butan-2-yl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[N-(butan-2-yl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
5-{[N-(butan-2-yl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-4291 |
| Compound Name: | 5-{[N-(butan-2-yl)-3-fluorobenzamido]methyl}-2-methoxyphenyl 3,4-dichlorobenzene-1-sulfonate |
| Molecular Weight: | 540.44 |
| Molecular Formula: | C25 H24 Cl2 F N O5 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(c1ccc(c(c1)[Cl])[Cl])(=O)=O)OC)C(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9458 |
| logD: | 5.9458 |
| logSw: | -6.1841 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.256 |
| InChI Key: | VNJNLUHOKICLAH-INIZCTEOSA-N |