5-Bromo-2',3'-O-isopropylideneuridine
TL;DR: 5-Bromo-2',3'-O-isopropylideneuridine (CAS 54503-61-6) is a chemical compound with molecular formula C12H15BrN2O6 and molecular weight 362.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-1-[(4R,6R)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione
Also Known As: EINECS 259-190-0, 5-Bromo-2',3'-O-isopropylideneuridine, 2',3'-O-isopropylidene-5-bromo-uridine, 5-bromo-1-[(4R,6R)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione, 5-Bromo-4-hydroxy-1-[2,3-O-(1-methylethylidene)pentofuranosyl]pyrimidin-2(1H)-one
| Molecular Formula | C12H15BrN2O6 |
|---|---|
| Molecular Weight | 362.01 g/mol |
| LogP | -0.2911 |
| Topological Polar Surface Area | 102.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 362.01135 |
| Heavy Atoms | 21 |
| Complexity | 668.4469 |
Chemical Identifiers
| CAS Number | 54503-61-6 |
|---|---|
| SMILES | CC1(OC2[C@H](O[C@H](C2O1)N3C=C(C(=O)NC3=O)Br)CO)C |
Product Overview
5-Bromo-2',3'-O-isopropylideneuridine (CAS 54503-61-6), with molecular formula C12H15BrN2O6 and molecular weight 362.01 g/mol. IUPAC: 5-bromo-1-[(4R,6R)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]pyrimidine-2,4-dione.
Chemical Property Profile of 5-Bromo-2',3'-O-isopropylideneuridine
Property Insights of 5-Bromo-2',3'-O-isopropylideneuridine
The XLogP value of -0.2911 indicates that 5-Bromo-2',3'-O-isopropylideneuridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-2',3'-O-isopropylideneuridine. Following Lipinski's Rule of Five, 5-Bromo-2',3'-O-isopropylideneuridine has 2 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 5-Bromo-2',3'-O-isopropylideneuridine?
The CAS number of 5-Bromo-2',3'-O-isopropylideneuridine is 54503-61-6.
What is the molecular formula of 5-Bromo-2',3'-O-isopropylideneuridine?
The molecular formula of 5-Bromo-2',3'-O-isopropylideneuridine is C12H15BrN2O6.
What is the molecular weight of 5-Bromo-2',3'-O-isopropylideneuridine?
The molecular weight of 5-Bromo-2',3'-O-isopropylideneuridine is 362.01 g/mol.
Where can I buy 5-Bromo-2',3'-O-isopropylideneuridine?
You can request a quote for 5-Bromo-2',3'-O-isopropylideneuridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-2',3'-O-isopropylideneuridine?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2',3'-O-isopropylideneuridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.