ethyl 2-amino-4-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Chemical Structure Depiction of
ethyl 2-amino-4-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
ethyl 2-amino-4-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8019-6597 |
| Compound Name: | ethyl 2-amino-4-(4,7-dimethoxy-6-propyl-2H-1,3-benzodioxol-5-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carboxylate |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C24 H29 N O8 |
| Smiles: | CCCc1c(C2C3=C(CCCC3=O)OC(=C2C(=O)OCC)N)c(c2c(c1OC)OCO2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7321 |
| logD: | 3.7321 |
| logSw: | -4.1625 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 95.218 |
| InChI Key: | GEGXVCQNUKNZGG-KRWDZBQOSA-N |