J1.129.785D
TL;DR: J1.129.785D (CAS 222737-84-0) is a chemical compound with molecular formula C11H14BrN5O4 and molecular weight 359.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5R)-5-(azidomethyl)-4-hydroxyoxolan-2-yl]-5-bromo-2-ethoxypyrimidin-4-one
Also Known As: J1.129.785D, 5'-Azido-5-bromo-2',5'-dideoxy-2-O-ethyluridine, uridine, 5'-azido-5-bromo-2',5'-dideoxy-2-O-ethyl-, 1-[(2R,4S,5R)-5-(azidomethyl)-4-hydroxyoxolan-2-yl]-5-bromo-2-ethoxypyrimidin-4-one, 1-[5-(2-Aza-2-diazovinyl)-4-hydroxyoxolan-2-yl]-5-bromo-2-ethoxyhydropyrimidin-4-one
| Molecular Formula | C11H14BrN5O4 |
|---|---|
| Molecular Weight | 359.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 85.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.02292 |
| Heavy Atoms | 21 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 222737-84-0 |
|---|---|
| SMILES | CCOC1=NC(=O)C(=CN1[C@H]2C[C@@H]([C@H](O2)CN=[N+]=[N-])O)Br |
| InChIKey | CVUAEFMUSUFHAU-DJLDLDEBSA-N |
Product Overview
J1.129.785D (CAS 222737-84-0), with molecular formula C11H14BrN5O4 and molecular weight 359.02 g/mol. IUPAC: 1-[(2R,4S,5R)-5-(azidomethyl)-4-hydroxyoxolan-2-yl]-5-bromo-2-ethoxypyrimidin-4-one.
Chemical Property Profile of J1.129.785D
Property Insights of J1.129.785D
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J1.129.785D. The TPSA of 85.7 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.129.785D. Following Lipinski's Rule of Five, J1.129.785D has 1 hydrogen bond donor(s) and 6 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 J1.129.785D?
The CAS number of J1.129.785D is 222737-84-0.
What is the molecular formula of J1.129.785D?
The molecular formula of J1.129.785D is C11H14BrN5O4.
What is the molecular weight of J1.129.785D?
The molecular weight of J1.129.785D is 359.02 g/mol.
Where can I buy J1.129.785D?
You can request a quote for J1.129.785D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.129.785D?
Yes, KEHONG BIO provides custom synthesis services for J1.129.785D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.