![8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione structure](/static/products/3132/313262-60-1.webp)
8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione
TL;DR: 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione (CAS 313262-60-1) is a chemical compound with molecular formula C14H10BrN5O5 and molecular weight 406.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione
Also Known As: UPCMLD0ENAT5878576:001, 8-bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 8-bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione, 8-bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]-1,3,7-trihydropurine-2,6-dio ne
| Molecular Formula | C14H10BrN5O5 |
|---|---|
| Molecular Weight | 406.99 g/mol |
| LogP | 0.9769 |
| Topological Polar Surface Area | 132.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.98654 |
| Heavy Atoms | 25 |
| Complexity | 1142.7004 |
Chemical Identifiers
| CAS Number | 313262-60-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CC(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione (CAS 313262-60-1), with molecular formula C14H10BrN5O5 and molecular weight 406.99 g/mol. IUPAC: 8-bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione.
Chemical Property Profile of 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione
Property Insights of 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione
The XLogP value of 0.9769 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione. The TPSA of 132.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione. Following Lipinski's Rule of Five, 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione 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 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione?
The CAS number of 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione is 313262-60-1.
What is the molecular formula of 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione?
The molecular formula of 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione is C14H10BrN5O5.
What is the molecular weight of 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione?
The molecular weight of 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione is 406.99 g/mol.
Where can I buy 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione?
You can request a quote for 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 8-Bromo-3-methyl-7-[2-(3-nitrophenyl)-2-oxoethyl]purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.