EB-47 dihydrochloride
TL;DR: EB-47 dihydrochloride (CAS 1190332-25-2) is a chemical compound with molecular formula C24H29Cl2N9O6 and molecular weight 609.1618 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[(2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolane-2-carbonyl]piperazin-1-yl]-N-(1-oxo-2,3-dihydroisoindol-4-yl)acetamide;dihydrochloride
Also Known As: EB-47 dihydrochloride, EB-47 (dihydrochloride), EB 47 dihydrochloride, EB-47 2HCl, EB 47, PARP-1 inhibitor
Technical Specifications
| Molecular Formula | C24H29Cl2N9O6 |
| Molecular Weight | 609.1618 g/mol |
| XLogP | -1.1024 |
| Topological Polar Surface Area (TPSA) | 201.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 5 |
| Exact Mass | 609.1618 Da |
| Heavy Atoms | 41 |
| Complexity | 951.0 |
| SMILES | C1CN(CCN1CC(=O)NC2=CC=CC3=C2CNC3=O)C(=O)[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O.Cl.Cl |
| InChIKey | VVMQSDIMNDTMII-MYXHFVDASA-N |
Chemical Property Profile of EB-47 dihydrochloride
Property Insights of EB-47 dihydrochloride
The XLogP value of -1.1024 indicates that EB-47 dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 201.0 Ų indicates high polarity, suggesting EB-47 dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EB-47 dihydrochloride has 7 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of EB-47 dihydrochloride?
The CAS number of EB-47 dihydrochloride is 1190332-25-2.
What is the molecular formula of EB-47 dihydrochloride?
The molecular formula of EB-47 dihydrochloride is C24H29Cl2N9O6.
What is the molecular weight of EB-47 dihydrochloride?
The molecular weight of EB-47 dihydrochloride is 609.1618 g/mol.
Where can I buy EB-47 dihydrochloride?
You can request a quote for EB-47 dihydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for EB-47 dihydrochloride?
Yes, CoreyChem provides custom synthesis services for EB-47 dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.