methyl 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate
Chemical Structure Depiction of
methyl 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate
methyl 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate
Compound characteristics
| Compound ID: | 8012-0123 |
| Compound Name: | methyl 4-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoate |
| Molecular Weight: | 373.37 |
| Molecular Formula: | C20 H15 N5 O3 |
| Smiles: | COC(c1ccc(cc1)C1C(C#N)=C(N)Oc2c1c(c1ccncc1)n[nH]2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7763 |
| logD: | 1.7712 |
| logSw: | -1.6636 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.075 |
| InChI Key: | VPWUZQWHNBOTNM-HNNXBMFYSA-N |