2-{[4-oxo-2-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-imidazol-5-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Chemical Structure Depiction of
2-{[4-oxo-2-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-imidazol-5-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
2-{[4-oxo-2-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-imidazol-5-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
Compound characteristics
| Compound ID: | 7591-0733 |
| Compound Name: | 2-{[4-oxo-2-phenyl-5-(trifluoromethyl)-4,5-dihydro-1H-imidazol-5-yl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Molecular Weight: | 404.41 |
| Molecular Formula: | C19 H15 F3 N4 O S |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC1(C(N=C(c3ccccc3)N1)=O)C(F)(F)F)s2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.018 |
| logD: | 1.5399 |
| logSw: | -4.3815 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.8 |
| InChI Key: | YSDLCEIQVOVXLW-SFHVURJKSA-N |