4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl benzoate
Chemical Structure Depiction of
4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl benzoate
4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl benzoate
Compound characteristics
| Compound ID: | K638-0079 |
| Compound Name: | 4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2,6-dimethoxyphenyl benzoate |
| Molecular Weight: | 508.53 |
| Molecular Formula: | C29 H24 N4 O5 |
| Smiles: | Cc1ccc(cc1)c1c2C(C(C#N)=C(N)Oc2[nH]n1)c1cc(c(c(c1)OC)OC(c1ccccc1)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3484 |
| logD: | 4.3484 |
| logSw: | -4.554 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.285 |
| InChI Key: | GOMKHKVFRLLBGZ-QHCPKHFHSA-N |