6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine
TL;DR: 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine (CAS 130359-85-2) is a chemical compound with molecular formula C24H23N5O4 and molecular weight 445.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[9-[(2R,4S,5R)-4-hydroxy-5-(phenylmethoxymethyl)oxolan-2-yl]purin-6-yl]benzamide
Also Known As: BB-Deoxyadenosine, 6-N-Benzoyl-5'-O-benzyl-2'-deoxyadenosine, N-Benzoyl-5'-O-benzyl-2'-deoxyadenosine, 6-N-Benzoyl-5/'-O-benzyl-2/'-deoxyadenosine, J2.808.150B
| Molecular Formula | C24H23N5O4 |
|---|---|
| Molecular Weight | 445.18 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 445.17502 |
| Heavy Atoms | 33 |
| Complexity | 642.0 |
Chemical Identifiers
| CAS Number | 130359-85-2 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)NC(=O)C4=CC=CC=C4)COCC5=CC=CC=C5)O |
| InChIKey | ABXIKYZXEAGUBB-XUVXKRRUSA-N |
Product Overview
6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine (CAS 130359-85-2), with molecular formula C24H23N5O4 and molecular weight 445.18 g/mol. IUPAC: N-[9-[(2R,4S,5R)-4-hydroxy-5-(phenylmethoxymethyl)oxolan-2-yl]purin-6-yl]benzamide.
Chemical Property Profile of 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine
Property Insights of 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine. Following Lipinski's Rule of Five, 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine has 2 hydrogen bond donor(s) and 7 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 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine?
The CAS number of 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine is 130359-85-2.
What is the molecular formula of 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine?
The molecular formula of 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine is C24H23N5O4.
What is the molecular weight of 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine?
The molecular weight of 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine is 445.18 g/mol.
Where can I buy 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine?
You can request a quote for 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine?
Yes, KEHONG BIO provides custom synthesis services for 6-N-benzoyl-5'-O-benzyl-2'-deoxyadenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.