N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide
N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide
Compound characteristics
| Compound ID: | V001-2535 |
| Compound Name: | N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-4-fluorobenzamide |
| Molecular Weight: | 441.59 |
| Molecular Formula: | C26 H36 F N3 O2 |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1cc(ccc1N(C)C)NC(CC(C)(C)C)=O)C(c1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8167 |
| logD: | 5.8061 |
| logSw: | -5.4393 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.431 |
| InChI Key: | BCMGBMZMLBUPAD-SFHVURJKSA-N |