N-[3-{[N-(butan-2-yl)(3-fluorophenyl)carbamamido]methyl}-4-(dimethylamino)phenyl]-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-[3-{[N-(butan-2-yl)(3-fluorophenyl)carbamamido]methyl}-4-(dimethylamino)phenyl]-3,3-dimethylbutanamide
N-[3-{[N-(butan-2-yl)(3-fluorophenyl)carbamamido]methyl}-4-(dimethylamino)phenyl]-3,3-dimethylbutanamide
Compound characteristics
| Compound ID: | V026-7578 |
| Compound Name: | N-[3-{[N-(butan-2-yl)(3-fluorophenyl)carbamamido]methyl}-4-(dimethylamino)phenyl]-3,3-dimethylbutanamide |
| Molecular Weight: | 456.6 |
| Molecular Formula: | C26 H37 F N4 O2 |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1cc(ccc1N(C)C)NC(CC(C)(C)C)=O)C(Nc1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1046 |
| logD: | 6.0924 |
| logSw: | -5.5012 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.252 |
| InChI Key: | AAFABMSIMBXJAF-SFHVURJKSA-N |