2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl methanesulfonate
Chemical Structure Depiction of
2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl methanesulfonate
2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-2825 |
| Compound Name: | 2-({2-chloro-N-[(4-fluorophenyl)methyl]benzamido}methyl)-5-(diethylamino)phenyl methanesulfonate |
| Molecular Weight: | 519.03 |
| Molecular Formula: | C26 H28 Cl F N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccc(cc2)F)C(c2ccccc2[Cl])=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8516 |
| logD: | 4.842 |
| logSw: | -4.918 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.15 |
| InChI Key: | NVLFWENTYQNIEY-UHFFFAOYSA-N |