N(6)-(1-indanyl)adenosine
TL;DR: N(6)-(1-indanyl)adenosine (CAS 96392-15-3) is a chemical compound with molecular formula C19H21N5O4 and molecular weight 383.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5R)-2-[6-(2,3-dihydro-1H-inden-1-ylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: N- adenosine, N(6)-(1-indanyl)adenosine, CI 947, N-(2,3-Dihydro-1H-inden-1-yl)adenosine, (R)-N-(2,3-Dihydro-1H-indenyl)adenosine
| Molecular Formula | C19H21N5O4 |
|---|---|
| Molecular Weight | 383.16 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 383.15936 |
| Heavy Atoms | 28 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 96392-15-3 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C1NC3=C4C(=NC=N3)N(C=N4)[C@H]5[C@@H]([C@@H]([C@H](O5)CO)O)O |
| InChIKey | FSKMJUWPFLDDRS-XTMLTMLVSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N(6)-(1-indanyl)adenosine (CAS 96392-15-3), with molecular formula C19H21N5O4 and molecular weight 383.16 g/mol. IUPAC: (2R,3R,4S,5R)-2-[6-(2,3-dihydro-1H-inden-1-ylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of N(6)-(1-indanyl)adenosine
Property Insights of N(6)-(1-indanyl)adenosine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(6)-(1-indanyl)adenosine. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N(6)-(1-indanyl)adenosine. Following Lipinski's Rule of Five, N(6)-(1-indanyl)adenosine 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 N(6)-(1-indanyl)adenosine?
The CAS number of N(6)-(1-indanyl)adenosine is 96392-15-3.
What is the molecular formula of N(6)-(1-indanyl)adenosine?
The molecular formula of N(6)-(1-indanyl)adenosine is C19H21N5O4.
What is the molecular weight of N(6)-(1-indanyl)adenosine?
The molecular weight of N(6)-(1-indanyl)adenosine is 383.16 g/mol.
Where can I buy N(6)-(1-indanyl)adenosine?
You can request a quote for N(6)-(1-indanyl)adenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(6)-(1-indanyl)adenosine?
Yes, KEHONG BIO provides custom synthesis services for N(6)-(1-indanyl)adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.