butyl 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
butyl 2-amino-1'-(2-methoxy-2-oxoethyl)-2',5-dioxo-1',2',5,6,7,8-hexahydrospiro[[1]benzopyran-4,3'-indole]-3-carboxylate
butyl 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: | 5587-0249 |
| Compound Name: | butyl 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: | 454.48 |
| Molecular Formula: | C24 H26 N2 O7 |
| Smiles: | CCCCOC(C1=C(N)OC2CCCC(C=2C12C(N(CC(=O)OC)c1ccccc12)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4368 |
| logD: | 2.4368 |
| logSw: | -3.0057 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.913 |
| InChI Key: | YSZIORSFKIROOA-XMMPIXPASA-N |