BAS 01054180
TL;DR: BAS 01054180 (CAS 334497-78-8) is a chemical compound with molecular formula C28H22N4O4S and molecular weight 510.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(3-nitrophenyl)acetamide
Also Known As: BAS 01054180, 2-((3-Cyano-6-(4-ethoxyphenyl)-4-phenylpyridin-2-yl)thio)-N-(3-nitrophenyl)acetamide, 2-[3-cyano-6-(4-ethoxyphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-(3-nitrophenyl)acetamide, 2-[3-Cyano-6-(4-ethoxy-phenyl)-4-phenyl-pyridin-2-ylsulfanyl]-N-(3-nitro-phenyl)-acetamide
| Molecular Formula | C28H22N4O4S |
|---|---|
| Molecular Weight | 510.14 g/mol |
| LogP | 6.32498 |
| Topological Polar Surface Area | 118.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 510.13617 |
| Heavy Atoms | 37 |
| Complexity | 1468.2599 |
Chemical Identifiers
| CAS Number | 334497-78-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
BAS 01054180 (CAS 334497-78-8), with molecular formula C28H22N4O4S and molecular weight 510.14 g/mol. IUPAC: 2-[[3-cyano-6-(4-ethoxyphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(3-nitrophenyl)acetamide.
Chemical Property Profile of BAS 01054180
Property Insights of BAS 01054180
The XLogP value of 6.32498 indicates that BAS 01054180 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.15 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01054180. Following Lipinski's Rule of Five, BAS 01054180 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01054180?
The CAS number of BAS 01054180 is 334497-78-8.
What is the molecular formula of BAS 01054180?
The molecular formula of BAS 01054180 is C28H22N4O4S.
What is the molecular weight of BAS 01054180?
The molecular weight of BAS 01054180 is 510.14 g/mol.
Where can I buy BAS 01054180?
You can request a quote for BAS 01054180 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01054180?
Yes, KEHONG BIO provides custom synthesis services for BAS 01054180 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.