N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide
N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V013-0235 |
| Compound Name: | N-{3-[(N-benzyl-3,3-dimethylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C29 H34 F N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(Cc1ccccc1)Cc1cc(ccc1N(C)C)NC(c1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0647 |
| logD: | 6.0615 |
| logSw: | -5.5374 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.517 |
| InChI Key: | SVBFLNMXNYWVBU-UHFFFAOYSA-N |