BAS 12663296
TL;DR: BAS 12663296 (CAS 876674-93-0) is a chemical compound with molecular formula C23H27N5O3 and molecular weight 421.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7,8-trimethyl-6-(oxolan-2-ylmethyl)-2-(2-phenylethyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12663296, UPCMLD0ENAT5816383:001, 1,6,7-trimethyl-3-(2-phenylethyl)-8-(tetrahydrofuran-2-ylmethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 4,7,8-trimethyl-6-(oxolan-2-ylmethyl)-2-(2-phenylethyl)purino[7,8-a]imidazole-1,3-dione, 4,7,8-trimethyl-6-(oxolan-2-ylmethyl)-2-phenethylpurino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C23H27N5O3 |
|---|---|
| Molecular Weight | 421.21 g/mol |
| LogP | 2.18794 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.2114 |
| Heavy Atoms | 31 |
| Complexity | 1384.6027 |
Chemical Identifiers
| CAS Number | 876674-93-0 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CC4CCCO4)N(C(=O)N(C3=O)CCC5=CC=CC=C5)C)C |
Product Overview
BAS 12663296 (CAS 876674-93-0), with molecular formula C23H27N5O3 and molecular weight 421.21 g/mol. IUPAC: 4,7,8-trimethyl-6-(oxolan-2-ylmethyl)-2-(2-phenylethyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12663296
Property Insights of BAS 12663296
The XLogP value of 2.18794 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12663296. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12663296. Following Lipinski's Rule of Five, BAS 12663296 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 12663296?
The CAS number of BAS 12663296 is 876674-93-0.
What is the molecular formula of BAS 12663296?
The molecular formula of BAS 12663296 is C23H27N5O3.
What is the molecular weight of BAS 12663296?
The molecular weight of BAS 12663296 is 421.21 g/mol.
Where can I buy BAS 12663296?
You can request a quote for BAS 12663296 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12663296?
Yes, KEHONG BIO provides custom synthesis services for BAS 12663296 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.