BAS 00734011
TL;DR: BAS 00734011 (CAS 329705-91-1) is a chemical compound with molecular formula C26H36N4O3S and molecular weight 484.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-dodecyl-3-methyl-8-phenacylsulfanylpurine-2,6-dione
Also Known As: BAS 00734011, 7-dodecyl-3-methyl-8-phenacylsulfanylpurine-2,6-dione, 7-dodecyl-3-methyl-8-[(2-oxo-2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione, 7-dodecyl-3-methyl-8-[(2-oxo-2-phenylethyl)sulfanyl]-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 7-dodecyl-3-methyl-8-((2-oxo-2-phenylethyl)thio)-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C26H36N4O3S |
|---|---|
| Molecular Weight | 484.25 g/mol |
| LogP | 5.3192 |
| Topological Polar Surface Area | 89.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 484.25082 |
| Heavy Atoms | 34 |
| Complexity | 1180.4592 |
Chemical Identifiers
| CAS Number | 329705-91-1 |
|---|---|
| SMILES | CCCCCCCCCCCCN1C2=C(N=C1SCC(=O)C3=CC=CC=C3)N(C(=O)NC2=O)C |
Product Overview
BAS 00734011 (CAS 329705-91-1), with molecular formula C26H36N4O3S and molecular weight 484.25 g/mol. IUPAC: 7-dodecyl-3-methyl-8-phenacylsulfanylpurine-2,6-dione.
Chemical Property Profile of BAS 00734011
Property Insights of BAS 00734011
The XLogP value of 5.3192 indicates that BAS 00734011 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00734011. Following Lipinski's Rule of Five, BAS 00734011 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00734011?
The CAS number of BAS 00734011 is 329705-91-1.
What is the molecular formula of BAS 00734011?
The molecular formula of BAS 00734011 is C26H36N4O3S.
What is the molecular weight of BAS 00734011?
The molecular weight of BAS 00734011 is 484.25 g/mol.
Where can I buy BAS 00734011?
You can request a quote for BAS 00734011 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00734011?
Yes, KEHONG BIO provides custom synthesis services for BAS 00734011 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.