4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V028-0040 |
| Compound Name: | 4-chloro-2-{[(cyclobutanecarbonyl)(2-methoxyethyl)amino]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 494.99 |
| Molecular Formula: | C23 H27 Cl N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(CCOC)C(C1CCC1)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.8708 |
| logD: | 2.8707 |
| logSw: | -3.5811 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.404 |
| InChI Key: | JZWLXWIUFUYQAL-UHFFFAOYSA-N |