5-{[N-(butan-2-yl)(3,4-difluorophenyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate
Chemical Structure Depiction of
5-{[N-(butan-2-yl)(3,4-difluorophenyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate
5-{[N-(butan-2-yl)(3,4-difluorophenyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate
Compound characteristics
| Compound ID: | V011-5983 |
| Compound Name: | 5-{[N-(butan-2-yl)(3,4-difluorophenyl)carbamamido]methyl}-2-methoxyphenyl methanesulfonate |
| Molecular Weight: | 442.48 |
| Molecular Formula: | C20 H24 F2 N2 O5 S |
| Smiles: | CCC(C)N(Cc1ccc(c(c1)OS(C)(=O)=O)OC)C(Nc1ccc(c(c1)F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7082 |
| logD: | 3.7081 |
| logSw: | -4.0517 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.464 |
| InChI Key: | WZDZJPJGZPKIIR-ZDUSSCGKSA-N |