BAS 00911162
TL;DR: BAS 00911162 (CAS 444152-07-2) is a chemical compound with molecular formula C28H22N4O3S and molecular weight 494.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-6-(4-methylphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide
Also Known As: BAS 00911162, 2-((3-Cyano-4-phenyl-6-(p-tolyl)pyridin-2-yl)thio)-N-(2-methyl-5-nitrophenyl)acetamide, 2-(3-Cyano-4-phenyl-6-p-tolyl-pyridin-2-ylsulfanyl)-N-(2-methyl-5-nitro-phenyl)-acetamide, 2-[3-cyano-6-(4-methylphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-(2-methyl-5-nitrophenyl)acetamide
| Molecular Formula | C28H22N4O3S |
|---|---|
| Molecular Weight | 494.14 g/mol |
| LogP | 6.54312 |
| Topological Polar Surface Area | 108.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 494.14127 |
| Heavy Atoms | 36 |
| Complexity | 1479.6561 |
Chemical Identifiers
| CAS Number | 444152-07-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])C |
Product Overview
BAS 00911162 (CAS 444152-07-2), with molecular formula C28H22N4O3S and molecular weight 494.14 g/mol. IUPAC: 2-[[3-cyano-6-(4-methylphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(2-methyl-5-nitrophenyl)acetamide.
Chemical Property Profile of BAS 00911162
Property Insights of BAS 00911162
The XLogP value of 6.54312 indicates that BAS 00911162 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.92 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00911162. Following Lipinski's Rule of Five, BAS 00911162 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 00911162?
The CAS number of BAS 00911162 is 444152-07-2.
What is the molecular formula of BAS 00911162?
The molecular formula of BAS 00911162 is C28H22N4O3S.
What is the molecular weight of BAS 00911162?
The molecular weight of BAS 00911162 is 494.14 g/mol.
Where can I buy BAS 00911162?
You can request a quote for BAS 00911162 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00911162?
Yes, KEHONG BIO provides custom synthesis services for BAS 00911162 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.