5-{[2-chloro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[2-chloro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
5-{[2-chloro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-2861 |
| Compound Name: | 5-{[2-chloro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 547.03 |
| Molecular Formula: | C26 H27 Cl N2 O7 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1cc(CN(CCOC)C(c2ccccc2[Cl])=O)ccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8922 |
| logD: | 2.8921 |
| logSw: | -3.6528 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.511 |
| InChI Key: | KPNQXPTYAKWEFN-UHFFFAOYSA-N |