BAS 00286866
TL;DR: BAS 00286866 (CAS 132373-42-3) is a chemical compound with molecular formula C15H12BrClN4O3 and molecular weight 409.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-bromo-7-[2-(4-chlorophenyl)-2-oxoethyl]-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 00286866, AB01309545-01, F0373-0155, 8-bromo-7-(2-(4-chlorophenyl)-2-oxoethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-bromo-7-[2-(4-chlorophenyl)-2-oxoethyl]-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
| Molecular Formula | C15H12BrClN4O3 |
|---|---|
| Molecular Weight | 409.98 g/mol |
| LogP | 1.7325 |
| Topological Polar Surface Area | 78.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.97812 |
| Heavy Atoms | 24 |
| Complexity | 1079.2678 |
Chemical Identifiers
| CAS Number | 132373-42-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Br)CC(=O)C3=CC=C(C=C3)Cl |
Product Overview
BAS 00286866 (CAS 132373-42-3), with molecular formula C15H12BrClN4O3 and molecular weight 409.98 g/mol. IUPAC: 8-bromo-7-[2-(4-chlorophenyl)-2-oxoethyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 00286866
Property Insights of BAS 00286866
The XLogP value of 1.7325 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00286866. The TPSA of 78.89 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00286866. Following Lipinski's Rule of Five, BAS 00286866 has 0 hydrogen bond donor(s) and 4 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 BAS 00286866?
The CAS number of BAS 00286866 is 132373-42-3.
What is the molecular formula of BAS 00286866?
The molecular formula of BAS 00286866 is C15H12BrClN4O3.
What is the molecular weight of BAS 00286866?
The molecular weight of BAS 00286866 is 409.98 g/mol.
Where can I buy BAS 00286866?
You can request a quote for BAS 00286866 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00286866?
Yes, KEHONG BIO provides custom synthesis services for BAS 00286866 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.