4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate
Chemical Structure Depiction of
4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate
4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate
Compound characteristics
| Compound ID: | IB02-7129 |
| Compound Name: | 4-(6-amino-5-cyano-3-propyl-2,4-dihydropyrano[2,3-c]pyrazol-4-yl)phenyl acetate |
| Molecular Weight: | 338.36 |
| Molecular Formula: | C18 H18 N4 O3 |
| Smiles: | CCCc1c2C(C(C#N)=C(N)Oc2n[nH]1)c1ccc(cc1)OC(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2 |
| logD: | 2.2 |
| logSw: | -3.06 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 187.11 |
| InChI Key: | YIINQCOSOCOBSY-HNNXBMFYSA-N |