N-[4-(dimethylamino)-3-({N-[(4-fluorophenyl)methyl]-2,2-dimethylpropanamido}methyl)phenyl]-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-[4-(dimethylamino)-3-({N-[(4-fluorophenyl)methyl]-2,2-dimethylpropanamido}methyl)phenyl]-3,3-dimethylbutanamide
N-[4-(dimethylamino)-3-({N-[(4-fluorophenyl)methyl]-2,2-dimethylpropanamido}methyl)phenyl]-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V026-2919 |
| Compound Name: | N-[4-(dimethylamino)-3-({N-[(4-fluorophenyl)methyl]-2,2-dimethylpropanamido}methyl)phenyl]-3,3-dimethylbutanamide |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C27 H38 F N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(Nc1ccc(c(CN(Cc2ccc(cc2)F)C(C(C)(C)C)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.75 |
| logD: | 5.7477 |
| logSw: | -5.4637 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.103 |
| InChI Key: | SIHHUZSQOBECBW-UHFFFAOYSA-N |