4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate
Chemical Structure Depiction of
4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate
4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | K638-0091 |
| Compound Name: | 4-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-methoxyphenyl thiophene-2-carboxylate |
| Molecular Weight: | 484.53 |
| Molecular Formula: | C26 H20 N4 O4 S |
| Smiles: | Cc1ccc(cc1)c1c2C(C(C#N)=C(N)Oc2[nH]n1)c1ccc(c(c1)OC)OC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4269 |
| logD: | 4.4269 |
| logSw: | -4.5869 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.586 |
| InChI Key: | OBMGVWQNYSXAPQ-NRFANRHFSA-N |