ethyl 5'-amino-6'-cyano-1-[2-(3-methoxyanilino)-2-oxoethyl]-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
Chemical Structure Depiction of
ethyl 5'-amino-6'-cyano-1-[2-(3-methoxyanilino)-2-oxoethyl]-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
ethyl 5'-amino-6'-cyano-1-[2-(3-methoxyanilino)-2-oxoethyl]-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate
Compound characteristics
| Compound ID: | 8018-4608 |
| Compound Name: | ethyl 5'-amino-6'-cyano-1-[2-(3-methoxyanilino)-2-oxoethyl]-2'-methyl-2-oxo-1,2-dihydrospiro[indole-3,7'-thieno[3,2-b]pyran]-3'-carboxylate |
| Molecular Weight: | 544.59 |
| Molecular Formula: | C28 H24 N4 O6 S |
| Smiles: | CCOC(c1c2c(C3(C(C#N)=C(N)O2)C(N(CC(Nc2cccc(c2)OC)=O)c2ccccc23)=O)sc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9365 |
| logD: | 3.9364 |
| logSw: | -4.3596 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.912 |
| InChI Key: | QBTOZGGCZRFJAP-NDEPHWFRSA-N |