methyl 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
Chemical Structure Depiction of
methyl 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
methyl 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate
Compound characteristics
| Compound ID: | 8010-8307 |
| Compound Name: | methyl 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)benzoate |
| Molecular Weight: | 310.31 |
| Molecular Formula: | C16 H14 N4 O3 |
| Smiles: | Cc1c2C(C(C#N)=C(N)Oc2[nH]n1)c1ccc(cc1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.552 |
| logD: | 1.552 |
| logSw: | -1.8828 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.725 |
| InChI Key: | FNWZZANWKZRZEI-ZDUSSCGKSA-N |