2-({tert-butyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-5-(diethylamino)phenyl methanesulfonate
Chemical Structure Depiction of
2-({tert-butyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-5-(diethylamino)phenyl methanesulfonate
2-({tert-butyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-5-(diethylamino)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V026-5770 |
| Compound Name: | 2-({tert-butyl-N-[(4-fluorophenyl)methyl]carbamamido}methyl)-5-(diethylamino)phenyl methanesulfonate |
| Molecular Weight: | 479.61 |
| Molecular Formula: | C24 H34 F N3 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccc(cc2)F)C(NC(C)(C)C)=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5019 |
| logD: | 4.4923 |
| logSw: | -4.2954 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.388 |
| InChI Key: | UASZWUGUPBVXBX-UHFFFAOYSA-N |