BAS 00512109
TL;DR: BAS 00512109 (CAS 326918-82-5) is a chemical compound with molecular formula C24H40N4O4S and molecular weight 480.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-hexadecyl-3-methyl-2,6-dioxopurin-8-yl)sulfanylacetic acid
Also Known As: BAS 00512109, 2-(7-hexadecyl-3-methyl-2,6-dioxopurin-8-yl)sulfanylacetic acid, [(7-hexadecyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetic acid, 2-[(7-Hexadecyl-2,3,6,7-tetrahydro-3-methyl-2,6-dioxo-1H-purin-8-yl)thio]acetic acid, 2-((7-hexadecyl-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetic acid
| Molecular Formula | C24H40N4O4S |
|---|---|
| Molecular Weight | 480.28 g/mol |
| LogP | 5.0813 |
| Topological Polar Surface Area | 109.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 18 |
| Exact Mass | 480.27704 |
| Heavy Atoms | 33 |
| Complexity | 979.22516 |
Chemical Identifiers
| CAS Number | 326918-82-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCN1C2=C(N=C1SCC(=O)O)N(C(=O)NC2=O)C |
Product Overview
BAS 00512109 (CAS 326918-82-5), with molecular formula C24H40N4O4S and molecular weight 480.28 g/mol. IUPAC: 2-(7-hexadecyl-3-methyl-2,6-dioxopurin-8-yl)sulfanylacetic acid.
Chemical Property Profile of BAS 00512109
Property Insights of BAS 00512109
The XLogP value of 5.0813 indicates that BAS 00512109 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 109.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00512109. Following Lipinski's Rule of Five, BAS 00512109 has 2 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 00512109?
The CAS number of BAS 00512109 is 326918-82-5.
What is the molecular formula of BAS 00512109?
The molecular formula of BAS 00512109 is C24H40N4O4S.
What is the molecular weight of BAS 00512109?
The molecular weight of BAS 00512109 is 480.28 g/mol.
Where can I buy BAS 00512109?
You can request a quote for BAS 00512109 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00512109?
Yes, KEHONG BIO provides custom synthesis services for BAS 00512109 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.