6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 8011-9067 |
Compound Name: | 6-amino-4-(3-ethoxy-4-hydroxy-5-nitrophenyl)-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 420.38 |
Molecular Formula: | C20 H16 N6 O5 |
Smiles: | CCOc1cc(cc(c1O)[N+]([O-])=O)C1C(C#N)=C(N)Oc2c1c(c1ccncc1)n[nH]2 |
Stereo: | RACEMIC MIXTURE |
logP: | 1.981 |
logD: | 1.4753 |
logSw: | -2.1589 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 135.671 |
InChI Key: | CKSPWZPAXMIEMS-HNNXBMFYSA-N |