Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-
TL;DR: Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- (CAS 5580-94-9) is a chemical compound with molecular formula C9H12BrN3O2 and molecular weight 273.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one
Also Known As: 5-Bromo-1-(tetrahydropyran-2-yl)cytosine, NCIOpen2_006695, 4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one, CYTOSINE, 5-BROMO-1-(TETRAHYDROPYRAN-2-YL)-, 4-Amino-5-bromo-1- pyrimidin-2 -one
| Molecular Formula | C9H12BrN3O2 |
|---|---|
| Molecular Weight | 273.01 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.0113 |
| Heavy Atoms | 15 |
| Complexity | 340.0 |
Chemical Identifiers
| CAS Number | 5580-94-9 |
|---|---|
| SMILES | C1CCOC(C1)N2C=C(C(=NC2=O)N)Br |
| InChIKey | VPNCDRSZEJJPSI-UHFFFAOYSA-N |
Product Overview
Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- (CAS 5580-94-9), with molecular formula C9H12BrN3O2 and molecular weight 273.01 g/mol. IUPAC: 4-amino-5-bromo-1-(oxan-2-yl)pyrimidin-2-one.
Chemical Property Profile of Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-
Property Insights of Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-. Following Lipinski's Rule of Five, Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- has 1 hydrogen bond donor(s) and 2 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 Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-?
The CAS number of Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- is 5580-94-9.
What is the molecular formula of Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-?
The molecular formula of Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- is C9H12BrN3O2.
What is the molecular weight of Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-?
The molecular weight of Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- is 273.01 g/mol.
Where can I buy Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-?
You can request a quote for Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Cytosine, 5-bromo-1-(tetrahydropyran-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.