ethyl 6'-amino-5'-cyano-2'-({[3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Chemical Structure Depiction of
ethyl 6'-amino-5'-cyano-2'-({[3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
ethyl 6'-amino-5'-cyano-2'-({[3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Compound characteristics
| Compound ID: | 8005-2648 |
| Compound Name: | ethyl 6'-amino-5'-cyano-2'-({[3-cyano-4-(4-fluorophenyl)-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate |
| Molecular Weight: | 635.7 |
| Molecular Formula: | C33 H22 F N5 O4 S2 |
| Smiles: | CCOC(C1=C(CSc2c(C#N)c(cc(c3cccs3)n2)c2ccc(cc2)F)OC(=C(C#N)C12C(Nc1ccccc12)=O)N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4854 |
| logD: | 6.4854 |
| logSw: | -5.6906 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 118.892 |
| InChI Key: | UWEJVABXYSJIBW-MGBGTMOVSA-N |