N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3-fluorobenzamido)phenyl]methyl}-3-fluorobenzamide
Chemical Structure Depiction of
N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3-fluorobenzamido)phenyl]methyl}-3-fluorobenzamide
N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3-fluorobenzamido)phenyl]methyl}-3-fluorobenzamide
Compound characteristics
| Compound ID: | V013-0394 |
| Compound Name: | N-(butan-2-yl)-N-{[2-(dimethylamino)-5-(3-fluorobenzamido)phenyl]methyl}-3-fluorobenzamide |
| Molecular Weight: | 465.54 |
| Molecular Formula: | C27 H29 F2 N3 O2 |
| Salt: | not_available |
| Smiles: | CCC(C)N(Cc1cc(ccc1N(C)C)NC(c1cccc(c1)F)=O)C(c1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7171 |
| logD: | 5.7055 |
| logSw: | -5.4394 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.373 |
| InChI Key: | JEBGAXYHRMGCTF-SFHVURJKSA-N |