2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Chemical Structure Depiction of
2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V026-1576 |
| Compound Name: | 2-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}phenyl 4-acetamidobenzene-1-sulfonate |
| Molecular Weight: | 500.55 |
| Molecular Formula: | C25 H25 F N2 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(=O)(=O)Oc1ccccc1CN(CCOC)C(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0176 |
| logD: | 3.0175 |
| logSw: | -3.5819 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.88 |
| InChI Key: | SECKRAOPUOPXMH-UHFFFAOYSA-N |