(E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine
TL;DR: (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine (CAS 657405-12-4) is a chemical compound with molecular formula C11H15BrN4O3 and molecular weight 330.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5R)-4-amino-5-(aminomethyl)oxolan-2-yl]-5-(2-bromoethenyl)pyrimidine-2,4-dione
Also Known As: 2,5-Furandicarboxaldehyde,monooxime, (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine, 3',5'-Diamino-5-(2-bromoethen-1-yl)-2',3',5'-trideoxyuridine, Uridine, 3',5'-diamino-5-[(1E)-2-bromoethenyl]-2',3',5'-trideoxy-, 1-[(2R,4S,5R)-4-amino-5-(aminomethyl)oxolan-2-yl]-5-(2-bromoethenyl)pyrimidine-2,4-dione
| Molecular Formula | C11H15BrN4O3 |
|---|---|
| Molecular Weight | 330.03 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.03275 |
| Heavy Atoms | 19 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 657405-12-4 |
|---|---|
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C=CBr)CN)N |
| InChIKey | PIQZKKPSMOEGSJ-DJLDLDEBSA-N |
Product Overview
(E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine (CAS 657405-12-4), with molecular formula C11H15BrN4O3 and molecular weight 330.03 g/mol. IUPAC: 1-[(2R,4S,5R)-4-amino-5-(aminomethyl)oxolan-2-yl]-5-(2-bromoethenyl)pyrimidine-2,4-dione.
Chemical Property Profile of (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine
Property Insights of (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine
The XLogP value of -0.5 indicates that (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine. Following Lipinski's Rule of Five, (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine has 3 hydrogen bond donor(s) and 5 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 (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine?
The CAS number of (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine is 657405-12-4.
What is the molecular formula of (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine?
The molecular formula of (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine is C11H15BrN4O3.
What is the molecular weight of (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine?
The molecular weight of (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine is 330.03 g/mol.
Where can I buy (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine?
You can request a quote for (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine?
Yes, KEHONG BIO provides custom synthesis services for (E)-3',5'-Diamino-5-(2-bromovinyl)-2',3',5'-trideoxyuridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.