ethyl [2,9-bis(4-methylphenyl)-1,3,4-trioxodecahydro-3bH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]pyrazin-3b-yl]acetate
Chemical Structure Depiction of
ethyl [2,9-bis(4-methylphenyl)-1,3,4-trioxodecahydro-3bH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]pyrazin-3b-yl]acetate
ethyl [2,9-bis(4-methylphenyl)-1,3,4-trioxodecahydro-3bH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]pyrazin-3b-yl]acetate
Compound characteristics
| Compound ID: | Y020-6492 |
| Compound Name: | ethyl [2,9-bis(4-methylphenyl)-1,3,4-trioxodecahydro-3bH-pyrrolo[3',4':3,4]pyrrolo[1,2-a]pyrazin-3b-yl]acetate |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C27 H29 N3 O5 |
| Smiles: | CCOC(CC12C3C(C(c4ccc(C)cc4)N2CCNC1=O)C(N(C3=O)c1ccc(C)cc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4207 |
| logD: | 2.4206 |
| logSw: | -2.8415 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.457 |
| InChI Key: | XMLXGBKNGMFWHC-UHFFFAOYSA-N |