N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-3-fluoro-N-[(oxolan-2-yl)methyl]benzamide
Chemical Structure Depiction of
N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-3-fluoro-N-[(oxolan-2-yl)methyl]benzamide
N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-3-fluoro-N-[(oxolan-2-yl)methyl]benzamide
Compound characteristics
| Compound ID: | V025-7221 |
| Compound Name: | N-{[2-(dimethylamino)-5-(3,3-dimethylbutanamido)phenyl]methyl}-3-fluoro-N-[(oxolan-2-yl)methyl]benzamide |
| Molecular Weight: | 469.6 |
| Molecular Formula: | C27 H36 F N3 O3 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(Nc1ccc(c(CN(CC2CCCO2)C(c2cccc(c2)F)=O)c1)N(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4243 |
| logD: | 4.4114 |
| logSw: | -4.4472 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.485 |
| InChI Key: | OWPZSEWOQHSNSA-HSZRJFAPSA-N |