Abamun
TL;DR: Abamun (CAS 1861-57-0) is a chemical compound with molecular formula C18H21N7O4 and molecular weight 399.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Abamun
(2S,3S,4R,5R)-5-[6-[(3-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide
Also Known As: Abamun, N(6)-(4-Aminobenzyl)adenosine-5'-N-methyluronamide, N(6)-(4-aminobenzyl)adenosine-5/'-N-methyluronamide, (2S,3S,4R,5R)-5-[6-[(3-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide, (2s,3s,4r,5r)-5-{6-[(3-aminobenzyl)amino]-9h-purin-9-yl}-3,4-dihydroxy-n-methyltetrahydrofuran-2-carboxamide(non-preferred name)
| Molecular Formula | C18H21N7O4 |
|---|---|
| Molecular Weight | 399.17 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1655 |
| Heavy Atoms | 29 |
| Complexity | 584.0 |
Chemical Identifiers
| CAS Number | 1861-57-0 |
|---|---|
| SMILES | CNC(=O)[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)NCC4=CC(=CC=C4)N)O)O |
| InChIKey | YCLVIQWVMXAGIF-MOROJQBDSA-N |
Product Overview
Abamun (CAS 1861-57-0), with molecular formula C18H21N7O4 and molecular weight 399.17 g/mol. IUPAC: (2S,3S,4R,5R)-5-[6-[(3-aminophenyl)methylamino]purin-9-yl]-3,4-dihydroxy-N-methyloxolane-2-carboxamide.
Chemical Property Profile of Abamun
Property Insights of Abamun
The XLogP value of -0.4 indicates that Abamun is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting Abamun may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Abamun has 5 hydrogen bond donor(s) and 9 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 Abamun?
The CAS number of Abamun is 1861-57-0.
What is the molecular formula of Abamun?
The molecular formula of Abamun is C18H21N7O4.
What is the molecular weight of Abamun?
The molecular weight of Abamun is 399.17 g/mol.
Where can I buy Abamun?
You can request a quote for Abamun directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Abamun?
Yes, KEHONG BIO provides custom synthesis services for Abamun and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.