2-methoxy-5-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
2-methoxy-5-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
2-methoxy-5-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V024-8156 |
| Compound Name: | 2-methoxy-5-{[N-(2-methoxyethyl)-3-methylbutanamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 453.53 |
| Molecular Formula: | C22 H28 F N O6 S |
| Smiles: | CC(C)CC(N(CCOC)Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3554 |
| logD: | 3.3554 |
| logSw: | -3.6985 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.993 |
| InChI Key: | JHYFHGNOIJLUDK-UHFFFAOYSA-N |