4-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl methanesulfonate
4-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-2841 |
| Compound Name: | 4-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 406.5 |
| Molecular Formula: | C20 H26 N2 O5 S |
| Smiles: | CCC(C)N(Cc1ccc(cc1)OS(C)(=O)=O)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7471 |
| logD: | 3.7471 |
| logSw: | -4.0093 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.68 |
| InChI Key: | GCTBVGNTIWYESM-HNNXBMFYSA-N |