4-chloro-2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
4-chloro-2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
4-chloro-2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5442 |
| Compound Name: | 4-chloro-2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 534.99 |
| Molecular Formula: | C25 H24 Cl F N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1CN(CCOC)C(c1cccc(c1)F)=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5823 |
| logD: | 3.5822 |
| logSw: | -4.0231 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.88 |
| InChI Key: | JBQVSHHFFONHTI-UHFFFAOYSA-N |