5-(diethylamino)-2-({2-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({2-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl methanesulfonate
5-(diethylamino)-2-({2-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V028-0099 |
| Compound Name: | 5-(diethylamino)-2-({2-fluoro-N-[(4-fluorophenyl)methyl]benzamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 502.58 |
| Molecular Formula: | C26 H28 F2 N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccc(cc2)F)C(c2ccccc2F)=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5732 |
| logD: | 4.5637 |
| logSw: | -4.4833 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.15 |
| InChI Key: | XAHZZBQDHKNPDN-UHFFFAOYSA-N |