3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]methyl}benzonitrile
Chemical Structure Depiction of
3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]methyl}benzonitrile
3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]methyl}benzonitrile
Compound characteristics
| Compound ID: | V009-3563 |
| Compound Name: | 3-{[({1-[(4-fluorophenyl)methyl]-1H-pyrrol-2-yl}methyl)(3-methylbutyl)amino]methyl}benzonitrile |
| Molecular Weight: | 389.52 |
| Molecular Formula: | C25 H28 F N3 |
| Salt: | not_available |
| Smiles: | CC(C)CCN(Cc1cccc(C#N)c1)Cc1cccn1Cc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 5.3229 |
| logD: | 5.3145 |
| logSw: | -5.5462 |
| Hydrogen bond acceptors count: | 2 |
| Polar surface area: | 23.0551 |
| InChI Key: | UQFRZBNIGCXMTI-UHFFFAOYSA-N |