2-thio-FAD
TL;DR: 2-thio-FAD (CAS 43203-75-4) is a chemical compound with molecular formula C27H33N9O14P2S and molecular weight 801.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(7,8-dimethyl-4-oxo-2-sulfanylidenebenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphate
Also Known As: 2-Thio-fad, [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(7,8-dimethyl-4-oxo-2-sulfanylidenebenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphate, Riboflavin-5'-(trihydrogen diphosphate), 2-thio-, 5'-5'-ester with adenosine, RefChem:89450
| Molecular Formula | C27H33N9O14P2S |
|---|---|
| Molecular Weight | 801.13 g/mol |
| LogP | -1.05467 |
| Topological Polar Surface Area | 345.86 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 13 |
| Exact Mass | 801.1343 |
| Heavy Atoms | 53 |
| Complexity | 2360.0327 |
Chemical Identifiers
| CAS Number | 43203-75-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1C)N(C3=NC(=S)NC(=O)C3=N2)CC(C(C(COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O |
Product Overview
2-thio-FAD (CAS 43203-75-4), with molecular formula C27H33N9O14P2S and molecular weight 801.13 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [5-(7,8-dimethyl-4-oxo-2-sulfanylidenebenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] hydrogen phosphate.
Chemical Property Profile of 2-thio-FAD
Property Insights of 2-thio-FAD
The XLogP value of -1.05467 indicates that 2-thio-FAD is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 345.86 Ų indicates high polarity, suggesting 2-thio-FAD may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-thio-FAD has 9 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-thio-FAD?
The CAS number of 2-thio-FAD is 43203-75-4.
What is the molecular formula of 2-thio-FAD?
The molecular formula of 2-thio-FAD is C27H33N9O14P2S.
What is the molecular weight of 2-thio-FAD?
The molecular weight of 2-thio-FAD is 801.13 g/mol.
Where can I buy 2-thio-FAD?
You can request a quote for 2-thio-FAD directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-thio-FAD?
Yes, KEHONG BIO provides custom synthesis services for 2-thio-FAD and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.