4-({[2,6-di(propan-2-yl)phenyl]-N-(2-methylpropyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
4-({[2,6-di(propan-2-yl)phenyl]-N-(2-methylpropyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
4-({[2,6-di(propan-2-yl)phenyl]-N-(2-methylpropyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V011-9103 |
| Compound Name: | 4-({[2,6-di(propan-2-yl)phenyl]-N-(2-methylpropyl)carbamamido}methyl)phenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 540.7 |
| Molecular Formula: | C30 H37 F N2 O4 S |
| Smiles: | CC(C)CN(Cc1ccc(cc1)OS(c1ccc(cc1)F)(=O)=O)C(Nc1c(cccc1C(C)C)C(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2695 |
| logD: | 6.2694 |
| logSw: | -5.534 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.636 |
| InChI Key: | KYCFSCMBDPLDEU-UHFFFAOYSA-N |