BAS 01547254
TL;DR: BAS 01547254 (CAS 332905-30-3) is a chemical compound with molecular formula C22H22N4O2S and molecular weight 406.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-1,3-dimethyl-8-(2-phenylethylsulfanyl)purine-2,6-dione
Also Known As: BAS 01547254, UPCMLD0ENAT5835061:001, 7-benzyl-1,3-dimethyl-8-[(2-phenylethyl)sulfanyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 7-benzyl-1,3-dimethyl-8-phenethylsulfanylpurine-2,6-dione, 1,3-dimethyl-8-(2-phenylethylthio)-7-benzyl-1,3,7-trihydropurine-2,6-dione
| Molecular Formula | C22H22N4O2S |
|---|---|
| Molecular Weight | 406.15 g/mol |
| LogP | 2.8168 |
| Topological Polar Surface Area | 61.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 406.14636 |
| Heavy Atoms | 29 |
| Complexity | 1257.4523 |
Chemical Identifiers
| CAS Number | 332905-30-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCC3=CC=CC=C3)CC4=CC=CC=C4 |
Product Overview
BAS 01547254 (CAS 332905-30-3), with molecular formula C22H22N4O2S and molecular weight 406.15 g/mol. IUPAC: 7-benzyl-1,3-dimethyl-8-(2-phenylethylsulfanyl)purine-2,6-dione.
Chemical Property Profile of BAS 01547254
Property Insights of BAS 01547254
The XLogP value of 2.8168 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01547254. The TPSA of 61.82 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01547254. Following Lipinski's Rule of Five, BAS 01547254 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 01547254?
The CAS number of BAS 01547254 is 332905-30-3.
What is the molecular formula of BAS 01547254?
The molecular formula of BAS 01547254 is C22H22N4O2S.
What is the molecular weight of BAS 01547254?
The molecular weight of BAS 01547254 is 406.15 g/mol.
Where can I buy BAS 01547254?
You can request a quote for BAS 01547254 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01547254?
Yes, KEHONG BIO provides custom synthesis services for BAS 01547254 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.