5-({[2,6-di(propan-2-yl)phenyl]-N-(2-methoxyethyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Chemical Structure Depiction of
5-({[2,6-di(propan-2-yl)phenyl]-N-(2-methoxyethyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
5-({[2,6-di(propan-2-yl)phenyl]-N-(2-methoxyethyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate
Compound characteristics
| Compound ID: | V005-5284 |
| Compound Name: | 5-({[2,6-di(propan-2-yl)phenyl]-N-(2-methoxyethyl)carbamamido}methyl)-2-methoxyphenyl 4-fluorobenzene-1-sulfonate |
| Molecular Weight: | 572.7 |
| Molecular Formula: | C30 H37 F N2 O6 S |
| Smiles: | CC(C)c1cccc(C(C)C)c1NC(N(CCOC)Cc1ccc(c(c1)OS(c1ccc(cc1)F)(=O)=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6702 |
| logD: | 4.6699 |
| logSw: | -4.4254 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.674 |
| InChI Key: | LZJKMAMDLGACEL-UHFFFAOYSA-N |