6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 3394-0298 |
Compound Name: | 6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(4-ethylphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 386.41 |
Molecular Formula: | C22 H18 N4 O3 |
Smiles: | CCc1ccc(cc1)C1C(C#N)=C(N)Oc2c1c(c1ccc3c(c1)OCO3)n[nH]2 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.8742 |
logD: | 3.8742 |
logSw: | -4.2286 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 87.589 |
InChI Key: | CZAAZORRYSKJGT-GOSISDBHSA-N |