N-[4-(dimethylamino)-3-({[(3-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl]-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-[4-(dimethylamino)-3-({[(3-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl]-3,3-dimethylbutanamide
N-[4-(dimethylamino)-3-({[(3-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl]-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V013-1474 |
| Compound Name: | N-[4-(dimethylamino)-3-({[(3-fluorophenyl)methyl](methoxyacetyl)amino}methyl)phenyl]-3,3-dimethylbutanamide |
| Molecular Weight: | 443.56 |
| Molecular Formula: | C25 H34 F N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(Nc1ccc(c(CN(Cc2cccc(c2)F)C(COC)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9847 |
| logD: | 3.9825 |
| logSw: | -4.2595 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.999 |
| InChI Key: | AGAPDYVWXKEFTO-UHFFFAOYSA-N |