2-methoxy-5-{[(2-methoxyphenyl)-N-(propan-2-yl)carbamamido]methyl}phenyl ethanesulfonate
Chemical Structure Depiction of
2-methoxy-5-{[(2-methoxyphenyl)-N-(propan-2-yl)carbamamido]methyl}phenyl ethanesulfonate
2-methoxy-5-{[(2-methoxyphenyl)-N-(propan-2-yl)carbamamido]methyl}phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V011-8924 |
| Compound Name: | 2-methoxy-5-{[(2-methoxyphenyl)-N-(propan-2-yl)carbamamido]methyl}phenyl ethanesulfonate |
| Molecular Weight: | 436.53 |
| Molecular Formula: | C21 H28 N2 O6 S |
| Smiles: | CCS(=O)(=O)Oc1cc(CN(C(C)C)C(Nc2ccccc2OC)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.4003 |
| logD: | 3.4003 |
| logSw: | -3.8225 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.772 |
| InChI Key: | XRILRJJUGFXNBO-UHFFFAOYSA-N |