2-Heptadecyl-6-methoxy-1,4-benzoquinone
2-[[4-[2-(2-amino-4-methyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioic acid
Also Known As: 2-Heptadecyl-6-methoxy-1,4-benzoquinone|2-[[4-[2-(2-amino-4-methyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioic acid|GPB
CAS: 78472-08-9
| Molecular Formula | C21H23N5O5 |
|---|---|
| Molecular Weight | 425.16992 g/mol |
| LogP | 1.68152 |
| Topological Polar Surface Area | 171.29 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 425.16992 |
| Monoisotopic Mass | 425.16992 |
| Heavy Atoms | 31 |
| Complexity | 1123.1409 |
Chemical Identifiers
| CAS Number | 78472-08-9 |
|---|---|
| SMILES | CC1=C2C(=CNC2=NC(=N1)N)CCC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O |
Product Overview
2-Heptadecyl-6-methoxy-1,4-benzoquinone (CAS 78472-08-9), with molecular formula C21H23N5O5 and molecular weight 425.16992 g/mol. IUPAC: 2-[[4-[2-(2-amino-4-methyl-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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2-Heptadecyl-6-methoxy-1,4-benzoquinone is a custom synthesis product. We offer services from milligram to kilogram scale.
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