5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate
Chemical Structure Depiction of
5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate
5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate
Compound characteristics
| Compound ID: | V008-8467 |
| Compound Name: | 5-(diethylamino)-2-({N-[(4-fluorophenyl)methyl]-3,3-dimethylbutanamido}methyl)phenyl methanesulfonate |
| Molecular Weight: | 478.63 |
| Molecular Formula: | C25 H35 F N2 O4 S |
| Salt: | not_available |
| Smiles: | CCN(CC)c1ccc(CN(Cc2ccc(cc2)F)C(CC(C)(C)C)=O)c(c1)OS(C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9457 |
| logD: | 4.9362 |
| logSw: | -4.8051 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.894 |
| InChI Key: | LBLSRKDRCWKOAB-UHFFFAOYSA-N |