3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutan-2-yl)amino]methyl}benzonitrile
Chemical Structure Depiction of
3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutan-2-yl)amino]methyl}benzonitrile
3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutan-2-yl)amino]methyl}benzonitrile
Compound characteristics
| Compound ID: | V009-3542 |
| Compound Name: | 3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutan-2-yl)amino]methyl}benzonitrile |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C25 H28 F N3 |
| Salt: | not_available |
| Smiles: | CC(C)C(C)N(Cc1cccc(C#N)c1)Cc1cccn1Cc1ccc(cc1)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4635 |
| logD: | 5.4388 |
| logSw: | -5.6397 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 22.3326 |
| InChI Key: | QRGGGHZEKCHDIU-FQEVSTJZSA-N |