2-methoxy-5-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
2-methoxy-5-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V011-5982 |
| Compound Name: | 2-methoxy-5-{[N-(2-methoxyethyl)(2-methylphenyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 502.56 |
| Molecular Formula: | C25 H27 F N2 O6 S |
| Smiles: | Cc1ccccc1NC(N(CCOC)Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8789 |
| logD: | 3.8789 |
| logSw: | -3.9205 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.372 |
| InChI Key: | MQKASEIPRONEGG-UHFFFAOYSA-N |