5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl propane-2-sulfonate
Chemical Structure Depiction of
5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl propane-2-sulfonate
5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl propane-2-sulfonate
Compound characteristics
| Compound ID: | V001-0892 |
| Compound Name: | 5-{[3-fluoro-N-(2-methoxyethyl)benzamido]methyl}-2-methoxyphenyl propane-2-sulfonate |
| Molecular Weight: | 439.5 |
| Molecular Formula: | C21 H26 F N O6 S |
| Smiles: | CC(C)S(=O)(=O)Oc1cc(CN(CCOC)C(c2cccc(c2)F)=O)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.5256 |
| logD: | 2.5256 |
| logSw: | -2.8293 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.52 |
| InChI Key: | NWXGWIRKOXYAKG-UHFFFAOYSA-N |