BAS 12663337
TL;DR: BAS 12663337 (CAS 876675-66-0) is a chemical compound with molecular formula C22H27N5O3 and molecular weight 409.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3-methoxypropyl)-4,7,8-trimethyl-2-(2-phenylethyl)purino[7,8-a]imidazole-1,3-dione
Also Known As: BAS 12663337, UPCMLD0ENAT5815062:001, 8-(3-methoxypropyl)-1,6,7-trimethyl-3-(2-phenylethyl)-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione, 6-(3-methoxypropyl)-4,7,8-trimethyl-2-(2-phenylethyl)purino[7,8-a]imidazole-1,3-dione, 6-(3-methoxypropyl)-4,7,8-trimethyl-2-phenethylpurino[7,8-a]imidazole-1,3-dione
| Molecular Formula | C22H27N5O3 |
|---|---|
| Molecular Weight | 409.21 g/mol |
| LogP | 2.04544 |
| Topological Polar Surface Area | 75.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 409.2114 |
| Heavy Atoms | 30 |
| Complexity | 1324.7994 |
Chemical Identifiers
| CAS Number | 876675-66-0 |
|---|---|
| SMILES | CC1=C(N2C3=C(N=C2N1CCCOC)N(C(=O)N(C3=O)CCC4=CC=CC=C4)C)C |
Product Overview
BAS 12663337 (CAS 876675-66-0), with molecular formula C22H27N5O3 and molecular weight 409.21 g/mol. IUPAC: 6-(3-methoxypropyl)-4,7,8-trimethyl-2-(2-phenylethyl)purino[7,8-a]imidazole-1,3-dione.
Chemical Property Profile of BAS 12663337
Property Insights of BAS 12663337
The XLogP value of 2.04544 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 12663337. The TPSA of 75.46 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 12663337. Following Lipinski's Rule of Five, BAS 12663337 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 12663337?
The CAS number of BAS 12663337 is 876675-66-0.
What is the molecular formula of BAS 12663337?
The molecular formula of BAS 12663337 is C22H27N5O3.
What is the molecular weight of BAS 12663337?
The molecular weight of BAS 12663337 is 409.21 g/mol.
Where can I buy BAS 12663337?
You can request a quote for BAS 12663337 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 12663337?
Yes, KEHONG BIO provides custom synthesis services for BAS 12663337 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.