4-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-ethoxyphenyl furan-2-carboxylate
Chemical Structure Depiction of
4-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-ethoxyphenyl furan-2-carboxylate
4-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-ethoxyphenyl furan-2-carboxylate
Compound characteristics
| Compound ID: | 3394-0385 |
| Compound Name: | 4-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-ethoxyphenyl furan-2-carboxylate |
| Molecular Weight: | 512.48 |
| Molecular Formula: | C27 H20 N4 O7 |
| Smiles: | CCOc1cc(ccc1OC(c1ccco1)=O)C1C(C#N)=C(N)Oc2c1c(c1ccc3c(c1)OCO3)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3293 |
| logD: | 3.3293 |
| logSw: | -3.6512 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 123.842 |
| InChI Key: | QFUREDCSGFJKOJ-QFIPXVFZSA-N |