2-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoic acid
Chemical Structure Depiction of
2-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoic acid
2-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoic acid
Compound characteristics
| Compound ID: | 8012-6667 |
| Compound Name: | 2-[6-amino-5-cyano-3-(pyridin-4-yl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]benzoic acid |
| Molecular Weight: | 359.34 |
| Molecular Formula: | C19 H13 N5 O3 |
| Smiles: | C(C1C(c2ccccc2C(O)=O)c2c(c3ccncc3)n[nH]c2OC=1N)#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4611 |
| logD: | -2.3772 |
| logSw: | -1.6207 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 108.31 |
| InChI Key: | LFFYQRWJUBIHQS-AWEZNQCLSA-N |