4-chloro-2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-3642 |
| Compound Name: | 4-chloro-2-{[2-chloro-N-(cyclopropylmethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 547.46 |
| Molecular Formula: | C26 H24 Cl2 N2 O5 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(CC1CC1)C(c1ccccc1[Cl])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.963 |
| logD: | 4.9629 |
| logSw: | -4.9001 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.811 |
| InChI Key: | SKGAIPQJTZXAQJ-UHFFFAOYSA-N |