BAS 00759004
TL;DR: BAS 00759004 (CAS 333341-80-3) is a chemical compound with molecular formula C29H25N3O2S and molecular weight 479.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-6-(4-methoxyphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(2,6-dimethylphenyl)acetamide
Also Known As: BAS 00759004, 2-((3-Cyano-6-(4-methoxyphenyl)-4-phenylpyridin-2-yl)thio)-N-(2,6-dimethylphenyl)acetamide, N-(2,6-dimethylphenyl)-2-[3-cyano-6-(4-methoxyphenyl)-4-phenyl(2-pyridylthio)] acetamide, 2-[3-Cyano-6-(4-methoxy-phenyl)-4-phenyl-pyridin-2-ylsulfanyl]-N-(2,6-dimethyl-phenyl)-acetamide, 2-[3-cyano-6-(4-methoxyphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-(2,6-dimethylphenyl)acetamide
| Molecular Formula | C29H25N3O2S |
|---|---|
| Molecular Weight | 479.17 g/mol |
| LogP | 6.64352 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 479.16675 |
| Heavy Atoms | 35 |
| Complexity | 1374.1035 |
Chemical Identifiers
| CAS Number | 333341-80-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=CC=C4)C#N |
Product Overview
BAS 00759004 (CAS 333341-80-3), with molecular formula C29H25N3O2S and molecular weight 479.17 g/mol. IUPAC: 2-[[3-cyano-6-(4-methoxyphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(2,6-dimethylphenyl)acetamide.
Chemical Property Profile of BAS 00759004
Property Insights of BAS 00759004
The XLogP value of 6.64352 indicates that BAS 00759004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00759004. Following Lipinski's Rule of Five, BAS 00759004 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 00759004?
The CAS number of BAS 00759004 is 333341-80-3.
What is the molecular formula of BAS 00759004?
The molecular formula of BAS 00759004 is C29H25N3O2S.
What is the molecular weight of BAS 00759004?
The molecular weight of BAS 00759004 is 479.17 g/mol.
Where can I buy BAS 00759004?
You can request a quote for BAS 00759004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00759004?
Yes, KEHONG BIO provides custom synthesis services for BAS 00759004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.