6-amino-4-(3,4-dimethoxyphenyl)-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-(3,4-dimethoxyphenyl)-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-(3,4-dimethoxyphenyl)-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 8009-1512 |
Compound Name: | 6-amino-4-(3,4-dimethoxyphenyl)-3-(trifluoromethyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 366.3 |
Molecular Formula: | C16 H13 F3 N4 O3 |
Smiles: | COc1ccc(cc1OC)C1C(C#N)=C(N)Oc2c1c(C(F)(F)F)n[nH]2 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.7598 |
logD: | 1.7598 |
logSw: | -2.1461 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 86.006 |
InChI Key: | BBONWWGRAGFHFS-NSHDSACASA-N |