N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(3-methylbutan-2-yl)butanamido]methyl}phenyl]-3-fluorobenzamide
Chemical Structure Depiction of
N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(3-methylbutan-2-yl)butanamido]methyl}phenyl]-3-fluorobenzamide
N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(3-methylbutan-2-yl)butanamido]methyl}phenyl]-3-fluorobenzamide
Compound characteristics
| Compound ID: | V013-1048 |
| Compound Name: | N-[4-(dimethylamino)-3-{[3,3-dimethyl-N-(3-methylbutan-2-yl)butanamido]methyl}phenyl]-3-fluorobenzamide |
| Molecular Weight: | 455.62 |
| Molecular Formula: | C27 H38 F N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)C(C)N(Cc1cc(ccc1N(C)C)NC(c1cccc(c1)F)=O)C(CC(C)(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5191 |
| logD: | 6.5165 |
| logSw: | -5.6631 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.153 |
| InChI Key: | XPZAMWIQWAFVCN-IBGZPJMESA-N |