AR-C 66096 free
TL;DR: AR-C 66096 free (CAS 145782-74-7) is a chemical compound with molecular formula C14H22F2N5O12P3S and molecular weight 615.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[[[(2R,3S,4R,5R)-5-(6-amino-2-propylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid
Also Known As: AR-C 66096 free, ARL 66096, AR-C66096, AR-C 66096 tetrasodium salt, AR-C-66069MX
| Molecular Formula | C14H22F2N5O12P3S |
|---|---|
| Molecular Weight | 615.02 g/mol |
| LogP | 0.5768 |
| Topological Polar Surface Area | 269.9 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 11 |
| Exact Mass | 615.01666 |
| Heavy Atoms | 37 |
| Complexity | 1296.2672 |
Chemical Identifiers
| CAS Number | 145782-74-7 |
|---|---|
| SMILES | CCCSC1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(C(F)(F)P(=O)(O)O)O)O)O)N |
Product Overview
AR-C 66096 free (CAS 145782-74-7), with molecular formula C14H22F2N5O12P3S and molecular weight 615.02 g/mol. IUPAC: [[[[(2R,3S,4R,5R)-5-(6-amino-2-propylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]-difluoromethyl]phosphonic acid.
Chemical Property Profile of AR-C 66096 free
Property Insights of AR-C 66096 free
The XLogP value of 0.5768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AR-C 66096 free. The TPSA of 269.9 Ų indicates high polarity, suggesting AR-C 66096 free may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AR-C 66096 free has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AR-C 66096 free?
The CAS number of AR-C 66096 free is 145782-74-7.
What is the molecular formula of AR-C 66096 free?
The molecular formula of AR-C 66096 free is C14H22F2N5O12P3S.
What is the molecular weight of AR-C 66096 free?
The molecular weight of AR-C 66096 free is 615.02 g/mol.
Where can I buy AR-C 66096 free?
You can request a quote for AR-C 66096 free directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AR-C 66096 free?
Yes, KEHONG BIO provides custom synthesis services for AR-C 66096 free and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.