6-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | Y509-0842 |
| Compound Name: | 6-amino-4-(4-methoxy-3-{[3-(trifluoromethyl)phenoxy]methyl}phenyl)-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 456.42 |
| Molecular Formula: | C23 H19 F3 N4 O3 |
| Smiles: | Cc1c2C(C(C#N)=C(N)Oc2[nH]n1)c1ccc(c(COc2cccc(c2)C(F)(F)F)c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6603 |
| logD: | 3.6603 |
| logSw: | -4.1921 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.409 |
| InChI Key: | LJIPMJJMZJPPLP-FQEVSTJZSA-N |