methyl 5-{[4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-ethoxyphenoxy]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-ethoxyphenoxy]methyl}furan-2-carboxylate
methyl 5-{[4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-ethoxyphenoxy]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | 4303-0799 |
| Compound Name: | methyl 5-{[4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)-2-ethoxyphenoxy]methyl}furan-2-carboxylate |
| Molecular Weight: | 450.45 |
| Molecular Formula: | C23 H22 N4 O6 |
| Smiles: | CCOc1cc(ccc1OCc1ccc(C(=O)OC)o1)C1C(C#N)=C(N)Oc2c1c(C)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1186 |
| logD: | 2.1186 |
| logSw: | -2.9095 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 114.091 |
| InChI Key: | QEJYBWQHYMMGSD-FQEVSTJZSA-N |