N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide
Chemical Structure Depiction of
N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide
N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide
Compound characteristics
| Compound ID: | V027-0038 |
| Compound Name: | N-{[2-(dimethylamino)-5-(3-methylbutanamido)phenyl]methyl}-N-[(3-fluorophenyl)methyl]-3-methylbenzamide |
| Molecular Weight: | 475.61 |
| Molecular Formula: | C29 H34 F N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)CC(Nc1ccc(c(CN(Cc2cccc(c2)F)C(c2cccc(C)c2)=O)c1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6412 |
| logD: | 5.6268 |
| logSw: | -5.4396 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.831 |
| InChI Key: | NRYGSLDAAXFFPQ-UHFFFAOYSA-N |