3-[6-amino-5-cyano-4-(4-methoxyphenyl)-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl]benzoic acid
Chemical Structure Depiction of
3-[6-amino-5-cyano-4-(4-methoxyphenyl)-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl]benzoic acid
3-[6-amino-5-cyano-4-(4-methoxyphenyl)-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl]benzoic acid
Compound characteristics
| Compound ID: | 8018-1595 |
| Compound Name: | 3-[6-amino-5-cyano-4-(4-methoxyphenyl)-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl]benzoic acid |
| Molecular Weight: | 402.41 |
| Molecular Formula: | C22 H18 N4 O4 |
| Smiles: | Cc1c2C(C(C#N)=C(N)Oc2n(c2cccc(c2)C(O)=O)n1)c1ccc(cc1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0596 |
| logD: | -1.0583 |
| logSw: | -3.3886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.269 |
| InChI Key: | AXXAWXYWTPWTDY-LJQANCHMSA-N |