2-methoxy-5-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
2-methoxy-5-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate
2-methoxy-5-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V026-5761 |
| Compound Name: | 2-methoxy-5-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 450.55 |
| Molecular Formula: | C22 H30 N2 O6 S |
| Smiles: | CCS(=O)(=O)Oc1cc(CN(CC(C)C)C(Nc2ccccc2OC)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.8872 |
| logD: | 3.8872 |
| logSw: | -3.9294 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.029 |
| InChI Key: | QFJHUTKXLGKBRB-UHFFFAOYSA-N |