methyl 2-amino-1'-(2-methoxy-2-oxoethyl)-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
Chemical Structure Depiction of
methyl 2-amino-1'-(2-methoxy-2-oxoethyl)-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
methyl 2-amino-1'-(2-methoxy-2-oxoethyl)-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
Compound characteristics
| Compound ID: | 5066-0346 |
| Compound Name: | methyl 2-amino-1'-(2-methoxy-2-oxoethyl)-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate |
| Molecular Weight: | 412.4 |
| Molecular Formula: | C21 H20 N2 O7 |
| Smiles: | COC(CN1C(C2(C3=C(CCCC3=O)OC(=C2C(=O)OC)N)c2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8798 |
| logD: | 0.8798 |
| logSw: | -2.2495 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.039 |
| InChI Key: | JNUCAFKMPUFGFZ-OAQYLSRUSA-N |