4-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl 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-methoxyphenyl 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-methoxyphenyl furan-2-carboxylate
Compound characteristics
| Compound ID: | 3394-0379 |
| Compound Name: | 4-[6-amino-3-(2H-1,3-benzodioxol-5-yl)-5-cyano-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl furan-2-carboxylate |
| Molecular Weight: | 498.45 |
| Molecular Formula: | C26 H18 N4 O7 |
| Smiles: | COc1cc(ccc1OC(c1ccco1)=O)C1C(C#N)=C(N)Oc2c1c(c1ccc3c(c1)OCO3)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1837 |
| logD: | 3.1837 |
| logSw: | -3.4889 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 124.262 |
| InChI Key: | NEBVLCCQHNSUNH-NRFANRHFSA-N |