N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]-2-phenylbutanamide
Chemical Structure Depiction of
N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]-2-phenylbutanamide
N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]-2-phenylbutanamide
Compound characteristics
| Compound ID: | V026-1186 |
| Compound Name: | N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]-2-phenylbutanamide |
| Molecular Weight: | 493.69 |
| Molecular Formula: | C30 H43 N3 O3 |
| Salt: | not_available |
| Smiles: | CCC(C(N(CC1CCCO1)Cc1cc(ccc1N(C)C)NC(CC(C)(C)C)=O)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5444 |
| logD: | 5.5424 |
| logSw: | -5.345 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.485 |
| InChI Key: | JNFDMTLAZXHYTK-UHFFFAOYSA-N |