3-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
3-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
3-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V027-2504 |
| Compound Name: | 3-{[ethyl-N-(2-methoxyethyl)carbamamido]methyl}phenyl 3-fluoro-4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 440.49 |
| Molecular Formula: | C20 H25 F N2 O6 S |
| Smiles: | CCNC(N(CCOC)Cc1cccc(c1)OS(c1ccc(c(c1)F)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.546 |
| logD: | 2.546 |
| logSw: | -2.952 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.202 |
| InChI Key: | JRRZLOQBCJHPEA-UHFFFAOYSA-N |