5-amino-3-(1-cyano-2-{1-[(2-fluorophenyl)methyl]-1H-indol-3-yl}ethenyl)-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Chemical Structure Depiction of
5-amino-3-(1-cyano-2-{1-[(2-fluorophenyl)methyl]-1H-indol-3-yl}ethenyl)-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
5-amino-3-(1-cyano-2-{1-[(2-fluorophenyl)methyl]-1H-indol-3-yl}ethenyl)-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Compound characteristics
| Compound ID: | 3601-0061 |
| Compound Name: | 5-amino-3-(1-cyano-2-{1-[(2-fluorophenyl)methyl]-1H-indol-3-yl}ethenyl)-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile |
| Molecular Weight: | 426.45 |
| Molecular Formula: | C24 H19 F N6 O |
| Smiles: | C(CO)n1c(c(C#N)c(/C(=C/c2cn(Cc3ccccc3F)c3ccccc23)C#N)n1)N |
| Stereo: | ACHIRAL |
| logP: | 2.8093 |
| logD: | 2.8093 |
| logSw: | -2.896 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.443 |
| InChI Key: | MGUWCYIFLIRPFC-UHFFFAOYSA-N |