4-chloro-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl methanesulfonate
Chemical Structure Depiction of
4-chloro-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl methanesulfonate
4-chloro-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl methanesulfonate
Compound characteristics
| Compound ID: | V001-5771 |
| Compound Name: | 4-chloro-2-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl methanesulfonate |
| Molecular Weight: | 440.94 |
| Molecular Formula: | C20 H25 Cl N2 O5 S |
| Smiles: | CC(C)CN(Cc1cc(ccc1OS(C)(=O)=O)[Cl])C(Nc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5888 |
| logD: | 4.5888 |
| logSw: | -4.6949 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.438 |
| InChI Key: | XIPVOHPTEKUKHJ-UHFFFAOYSA-N |