N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide
Chemical Structure Depiction of
N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide
N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide
Compound characteristics
| Compound ID: | V004-6424 |
| Compound Name: | N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide |
| Molecular Weight: | 489.63 |
| Molecular Formula: | C30 H36 F N3 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)C(N(Cc1cccc(c1)F)Cc1cc(ccc1N(C)C)NC(CC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.075 |
| logD: | 6.0606 |
| logSw: | -5.5426 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.831 |
| InChI Key: | SCMINHVIZUOEFD-UHFFFAOYSA-N |