3-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V006-5648 |
| Compound Name: | 3-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 472.53 |
| Molecular Formula: | C24 H25 F N2 O5 S |
| Smiles: | Cc1ccccc1NC(N(CCOC)Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.184 |
| logD: | 4.184 |
| logSw: | -4.2107 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.655 |
| InChI Key: | FUUIJTUJGDPATK-UHFFFAOYSA-N |