2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-6687 |
| Compound Name: | 2-methoxy-5-{[N-(2-methoxyethyl)(propan-2-yl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 466.55 |
| Molecular Formula: | C22 H30 N2 O7 S |
| Smiles: | CC(C)NC(N(CCOC)Cc1ccc(c(c1)OS(c1ccc(cc1)OC)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8597 |
| logD: | 2.8597 |
| logSw: | -3.6234 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.181 |
| InChI Key: | XGEDZQYKVXXWGN-UHFFFAOYSA-N |