3-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
3-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
3-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V025-5604 |
| Compound Name: | 3-{[(2-methoxyphenyl)-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 486.56 |
| Molecular Formula: | C25 H27 F N2 O5 S |
| Smiles: | CC(C)CN(Cc1cccc(c1)OS(c1ccc(cc1)F)(=O)=O)C(Nc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4785 |
| logD: | 5.4785 |
| logSw: | -5.4011 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.964 |
| InChI Key: | SNWIGGQOEAAJCO-UHFFFAOYSA-N |