5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate
TL;DR: 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate (CAS 75206-89-2) is a chemical compound with molecular formula C12H13Cl2N2O7P and molecular weight 397.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4R,5R)-2-(5,6-dichlorobenzimidazol-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate
Also Known As: Dcrfb 2'-phosphate, Dcrfb-2'-monophosphate, 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate, 5,6-dichloro-1- benzimidazole2'-phosphate, Dichlororibofuranosylbenzimidazole 2'-monophosphate
| Molecular Formula | C12H13Cl2N2O7P |
|---|---|
| Molecular Weight | 397.98 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 397.98373 |
| Heavy Atoms | 24 |
| Complexity | 512.0 |
Chemical Identifiers
| CAS Number | 75206-89-2 |
|---|---|
| SMILES | C1=C2C(=CC(=C1Cl)Cl)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)OP(=O)(O)O |
| InChIKey | XSKLIPONBPTDBE-DDHJBXDOSA-N |
Product Overview
5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate (CAS 75206-89-2), with molecular formula C12H13Cl2N2O7P and molecular weight 397.98 g/mol. IUPAC: [(2R,3R,4R,5R)-2-(5,6-dichlorobenzimidazol-1-yl)-4-hydroxy-5-(hydroxymethyl)oxolan-3-yl] dihydrogen phosphate.
Chemical Property Profile of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate
Property Insights of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate. Following Lipinski's Rule of Five, 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate?
The CAS number of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate is 75206-89-2.
What is the molecular formula of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate?
The molecular formula of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate is C12H13Cl2N2O7P.
What is the molecular weight of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate?
The molecular weight of 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate is 397.98 g/mol.
Where can I buy 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate?
You can request a quote for 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate?
Yes, KEHONG BIO provides custom synthesis services for 5,6-Dichloro-1-(beta-ribofuranosyl)benzimidazole 2'-phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.