5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate
5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V025-4535 |
| Compound Name: | 5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-2-methylpropanamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 450.57 |
| Molecular Formula: | C23 H31 F N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccc(cc2)F)C(C(C)C)=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0694 |
| logD: | 4.0598 |
| logSw: | -4.026 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.421 |
| InChI Key: | GQRHIHACYBUOIM-UHFFFAOYSA-N |