N-{3-[(N-benzyl-2-phenylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-{3-[(N-benzyl-2-phenylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide
N-{3-[(N-benzyl-2-phenylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V001-0931 |
| Compound Name: | N-{3-[(N-benzyl-2-phenylbutanamido)methyl]-4-(dimethylamino)phenyl}-3-fluorobenzamide |
| Molecular Weight: | 523.65 |
| Molecular Formula: | C33 H34 F N3 O2 |
| Salt: | not_available |
| Smiles: | CCC(C(N(Cc1ccccc1)Cc1cc(ccc1N(C)C)NC(c1cccc(c1)F)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.7151 |
| logD: | 6.7118 |
| logSw: | -5.6804 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.773 |
| InChI Key: | TUQNWEZEFSHGCJ-SSEXGKCCSA-N |