methyl 6'-amino-5-bromo-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Chemical Structure Depiction of
methyl 6'-amino-5-bromo-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
methyl 6'-amino-5-bromo-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate
Compound characteristics
| Compound ID: | 5066-0084 |
| Compound Name: | methyl 6'-amino-5-bromo-5'-cyano-2'-(2-methoxy-2-oxoethyl)-2-oxo-1,2-dihydrospiro[indole-3,4'-pyran]-3'-carboxylate |
| Molecular Weight: | 448.23 |
| Molecular Formula: | C18 H14 Br N3 O6 |
| Smiles: | COC(CC1=C(C(=O)OC)C2(C(C#N)=C(N)O1)C(Nc1ccc(cc12)[Br])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5855 |
| logD: | 1.5841 |
| logSw: | -2.4178 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.883 |
| InChI Key: | GGHORZCINPCAIN-GOSISDBHSA-N |