5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-9711 |
| Compound Name: | 5-{[3,3-dimethyl-N-(2-methylpropyl)butanamido]methyl}-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 465.58 |
| Molecular Formula: | C24 H32 F N O5 S |
| Smiles: | CC(C)CN(Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)C(CC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1343 |
| logD: | 5.1343 |
| logSw: | -5.1169 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.672 |
| InChI Key: | YHHGFEXMVPUOIS-UHFFFAOYSA-N |