4-[6-amino-5-cyano-3-(2,4-dichlorophenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-bromo-6-ethoxyphenyl thiophene-2-carboxylate
Chemical Structure Depiction of
4-[6-amino-5-cyano-3-(2,4-dichlorophenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-bromo-6-ethoxyphenyl thiophene-2-carboxylate
4-[6-amino-5-cyano-3-(2,4-dichlorophenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-bromo-6-ethoxyphenyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 8011-7194 |
| Compound Name: | 4-[6-amino-5-cyano-3-(2,4-dichlorophenyl)-1,4-dihydropyrano[2,3-c]pyrazol-4-yl]-2-bromo-6-ethoxyphenyl thiophene-2-carboxylate |
| Molecular Weight: | 632.32 |
| Molecular Formula: | C26 H17 Br Cl2 N4 O4 S |
| Smiles: | CCOc1cc(cc(c1OC(c1cccs1)=O)[Br])C1C(C#N)=C(N)Oc2c1c(c1ccc(cc1[Cl])[Cl])n[nH]2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1604 |
| logD: | 6.1604 |
| logSw: | -6.1531 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.253 |
| InChI Key: | GTMDASJKVPBYDU-FQEVSTJZSA-N |