4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate
Chemical Structure Depiction of
4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate
4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate
Compound characteristics
| Compound ID: | 8001-1445 |
| Compound Name: | 4-(6-amino-5-cyano-3-methyl-1,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate |
| Molecular Weight: | 310.31 |
| Molecular Formula: | C16 H14 N4 O3 |
| Smiles: | CC(=O)Oc1ccc(cc1)C1C(C#N)=C(N)Oc2c1c(C)n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9405 |
| logD: | 0.9405 |
| logSw: | -1.8064 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.302 |
| InChI Key: | UJYDXGKMPAMBMG-AWEZNQCLSA-N |