2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V029-9731 |
| Compound Name: | 2-{[N-(butan-2-yl)(2-methoxyphenyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 516.59 |
| Molecular Formula: | C26 H29 F N2 O6 S |
| Smiles: | CCC(C)N(Cc1ccccc1OS(c1ccc(c(c1)F)OC)(=O)=O)C(Nc1ccccc1OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6264 |
| logD: | 5.6264 |
| logSw: | -5.3931 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.01 |
| InChI Key: | ZMXDGPIUFNQXTD-SFHVURJKSA-N |