4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate
Chemical Structure Depiction of
4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate
4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate
Compound characteristics
Compound ID: | 3394-0172 |
Compound Name: | 4-[6-amino-5-cyano-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate |
Molecular Weight: | 560.59 |
Molecular Formula: | C28 H24 N4 O7 S |
Smiles: | COc1cc(ccc1OC(c1cccs1)=O)C1C(C#N)=C(N)Oc2c1c(c1cc(c(c(c1)OC)OC)OC)n[nH]2 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7478 |
logD: | 3.7478 |
logSw: | -4.311 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 122.564 |
InChI Key: | SRPFIOLWCAQREJ-QFIPXVFZSA-N |