BAS 00396606
TL;DR: BAS 00396606 (CAS 327167-66-8) is a chemical compound with molecular formula C17H27N5O3S and molecular weight 381.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-7-nonyl-2,6-dioxopurin-8-yl)sulfanylacetamide
Also Known As: BAS 00396606, 2-[(3-methyl-7-nonyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide, 2-(3-methyl-7-nonyl-2,6-dioxopurin-8-yl)sulfanylacetamide, 2-((3-methyl-7-nonyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)thio)acetamide, 2-(3-ME-7-NONYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YLSULFANYL)-ACETAMIDE
| Molecular Formula | C17H27N5O3S |
|---|---|
| Molecular Weight | 381.18 g/mol |
| LogP | 1.7513 |
| Topological Polar Surface Area | 115.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 381.18347 |
| Heavy Atoms | 26 |
| Complexity | 867.6311 |
Chemical Identifiers
| CAS Number | 327167-66-8 |
|---|---|
| SMILES | CCCCCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)NC2=O)C |
Product Overview
BAS 00396606 (CAS 327167-66-8), with molecular formula C17H27N5O3S and molecular weight 381.18 g/mol. IUPAC: 2-(3-methyl-7-nonyl-2,6-dioxopurin-8-yl)sulfanylacetamide.
Chemical Property Profile of BAS 00396606
Property Insights of BAS 00396606
The XLogP value of 1.7513 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00396606. The TPSA of 115.77 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00396606. Following Lipinski's Rule of Five, BAS 00396606 has 2 hydrogen bond donor(s) and 5 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 00396606?
The CAS number of BAS 00396606 is 327167-66-8.
What is the molecular formula of BAS 00396606?
The molecular formula of BAS 00396606 is C17H27N5O3S.
What is the molecular weight of BAS 00396606?
The molecular weight of BAS 00396606 is 381.18 g/mol.
Where can I buy BAS 00396606?
You can request a quote for BAS 00396606 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00396606?
Yes, KEHONG BIO provides custom synthesis services for BAS 00396606 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.