4-{[cyclohexyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-{[cyclohexyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
4-{[cyclohexyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V014-2015 |
| Compound Name: | 4-{[cyclohexyl-N-(2-methylpropyl)carbamamido]methyl}phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 462.58 |
| Molecular Formula: | C24 H31 F N2 O4 S |
| Smiles: | CC(C)CN(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)C(NC1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6138 |
| logD: | 5.6138 |
| logSw: | -5.1991 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.079 |
| InChI Key: | KQGHNFLETQWQHW-UHFFFAOYSA-N |