propyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate
Chemical Structure Depiction of
propyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate
propyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | Y508-2607 |
| Compound Name: | propyl 3a,8b-dihydroxy-2-methyl-4-oxo-1,3a,4,8b-tetrahydroindeno[1,2-b]pyrrole-3-carboxylate |
| Molecular Weight: | 303.31 |
| Molecular Formula: | C16 H17 N O5 |
| Smiles: | CCCOC(C1=C(C)NC2(c3ccccc3C(C12O)=O)O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.697 |
| logD: | 1.676 |
| logSw: | -2.5843 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.438 |
| InChI Key: | XCMCQTWJJCRMCW-UHFFFAOYSA-N |