N(6)-Phenyl-N(6)-allyladenosine
TL;DR: N(6)-Phenyl-N(6)-allyladenosine (CAS 61732-92-1) 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,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(N-prop-2-enylanilino)purin-9-yl]oxolane-3,4-diol
Also Known As: N(6)-Phenyl-N(6)-allyladenosine, 1,3-Dioxepane, 2-heptyl-, Adenosine, N-phenyl-N-2-propenyl-, n-phenyl-n-prop-2-en-1-yladenosine, BM 11189
| Molecular Formula | C19H21N5O4 |
|---|---|
| Molecular Weight | 383.16 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 383.15936 |
| Heavy Atoms | 28 |
| Complexity | 534.0 |
Chemical Identifiers
| CAS Number | 61732-92-1 |
|---|---|
| SMILES | C=CCN(C1=CC=CC=C1)C2=NC=NC3=C2N=CN3[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O |
| InChIKey | JKOCKLFBFNXCOT-NVQRDWNXSA-N |
Product Overview
N(6)-Phenyl-N(6)-allyladenosine (CAS 61732-92-1), with molecular formula C19H21N5O4 and molecular weight 383.16 g/mol. IUPAC: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(N-prop-2-enylanilino)purin-9-yl]oxolane-3,4-diol.
Chemical Property Profile of N(6)-Phenyl-N(6)-allyladenosine
Property Insights of N(6)-Phenyl-N(6)-allyladenosine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N(6)-Phenyl-N(6)-allyladenosine. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N(6)-Phenyl-N(6)-allyladenosine. Following Lipinski's Rule of Five, N(6)-Phenyl-N(6)-allyladenosine has 3 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)-Phenyl-N(6)-allyladenosine?
The CAS number of N(6)-Phenyl-N(6)-allyladenosine is 61732-92-1.
What is the molecular formula of N(6)-Phenyl-N(6)-allyladenosine?
The molecular formula of N(6)-Phenyl-N(6)-allyladenosine is C19H21N5O4.
What is the molecular weight of N(6)-Phenyl-N(6)-allyladenosine?
The molecular weight of N(6)-Phenyl-N(6)-allyladenosine is 383.16 g/mol.
Where can I buy N(6)-Phenyl-N(6)-allyladenosine?
You can request a quote for N(6)-Phenyl-N(6)-allyladenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(6)-Phenyl-N(6)-allyladenosine?
Yes, KEHONG BIO provides custom synthesis services for N(6)-Phenyl-N(6)-allyladenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.