BAS 00851062
TL;DR: BAS 00851062 (CAS 332040-48-9) is a chemical compound with molecular formula C30H27N3O3S and molecular weight 509.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-phenyl-2-pyridinyl]sulfanyl]-N-(2,4-dimethylphenyl)acetamide
Also Known As: BAS 00851062, 2-((3-Cyano-4-(3,4-dimethoxyphenyl)-6-phenylpyridin-2-yl)thio)-N-(2,4-dimethylphenyl)acetamide, 2-[3-cyano-4-(3,4-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(2,4-dimethylphenyl)acetamide, 2-[3-Cyano-4-(3,4-dimethoxy-phenyl)-6-phenyl-pyridin-2-ylsulfanyl]-N-(2,4-dimethyl-phenyl)-acetamide, 2-[4-(3,4-dimethoxyphenyl)-3-cyano-6-phenyl(2-pyridylthio)]-N-(2,4-dimethylphe nyl)acetamide
| Molecular Formula | C30H27N3O3S |
|---|---|
| Molecular Weight | 509.18 g/mol |
| LogP | 6.65212 |
| Topological Polar Surface Area | 84.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 509.1773 |
| Heavy Atoms | 37 |
| Complexity | 1479.8895 |
Chemical Identifiers
| CAS Number | 332040-48-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=CC(=C(C=C4)OC)OC)C#N)C |
Product Overview
BAS 00851062 (CAS 332040-48-9), with molecular formula C30H27N3O3S and molecular weight 509.18 g/mol. IUPAC: 2-[[3-cyano-4-(3,4-dimethoxyphenyl)-6-phenyl-2-pyridinyl]sulfanyl]-N-(2,4-dimethylphenyl)acetamide.
Chemical Property Profile of BAS 00851062
Property Insights of BAS 00851062
The XLogP value of 6.65212 indicates that BAS 00851062 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.24 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00851062. Following Lipinski's Rule of Five, BAS 00851062 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00851062?
The CAS number of BAS 00851062 is 332040-48-9.
What is the molecular formula of BAS 00851062?
The molecular formula of BAS 00851062 is C30H27N3O3S.
What is the molecular weight of BAS 00851062?
The molecular weight of BAS 00851062 is 509.18 g/mol.
Where can I buy BAS 00851062?
You can request a quote for BAS 00851062 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00851062?
Yes, KEHONG BIO provides custom synthesis services for BAS 00851062 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.