3-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl thiophene-2-carboxylate
Chemical Structure Depiction of
3-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl thiophene-2-carboxylate
3-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | K638-0087 |
| Compound Name: | 3-[6-amino-5-cyano-3-(4-methylphenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]phenyl thiophene-2-carboxylate |
| Molecular Weight: | 454.51 |
| Molecular Formula: | C25 H18 N4 O3 S |
| Smiles: | Cc1ccc(cc1)c1c2C(C(C#N)=C(N)Oc2[nH]n1)c1cccc(c1)OC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3541 |
| logD: | 4.3541 |
| logSw: | -4.537 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.869 |
| InChI Key: | QSGZMABYPWSTHA-FQEVSTJZSA-N |