BAS 01248057
TL;DR: BAS 01248057 (CAS 332171-33-2) 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-methylphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(2-methoxy-4-nitrophenyl)acetamide
Also Known As: BAS 01248057, 2-((3-Cyano-4-phenyl-6-(p-tolyl)pyridin-2-yl)thio)-N-(2-methoxy-4-nitrophenyl)acetamide, 2-(3-Cyano-4-phenyl-6-p-tolyl-pyridin-2-ylsulfanyl)-N-(2-methoxy-4-nitro-phenyl)-acetamide, 2-[3-cyano-6-(4-methylphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-(2-methoxy-4-nitrophenyl)acetamide
| Molecular Formula | C28H22N4O4S |
|---|---|
| Molecular Weight | 510.14 g/mol |
| LogP | 6.2433 |
| Topological Polar Surface Area | 118.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 510.13617 |
| Heavy Atoms | 37 |
| Complexity | 1499.6073 |
Chemical Identifiers
| CAS Number | 332171-33-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CC=C3)C#N)SCC(=O)NC4=C(C=C(C=C4)[N+](=O)[O-])OC |
Product Overview
BAS 01248057 (CAS 332171-33-2), with molecular formula C28H22N4O4S and molecular weight 510.14 g/mol. IUPAC: 2-[[3-cyano-6-(4-methylphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(2-methoxy-4-nitrophenyl)acetamide.
Chemical Property Profile of BAS 01248057
Property Insights of BAS 01248057
The XLogP value of 6.2433 indicates that BAS 01248057 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 01248057. Following Lipinski's Rule of Five, BAS 01248057 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 01248057?
The CAS number of BAS 01248057 is 332171-33-2.
What is the molecular formula of BAS 01248057?
The molecular formula of BAS 01248057 is C28H22N4O4S.
What is the molecular weight of BAS 01248057?
The molecular weight of BAS 01248057 is 510.14 g/mol.
Where can I buy BAS 01248057?
You can request a quote for BAS 01248057 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01248057?
Yes, KEHONG BIO provides custom synthesis services for BAS 01248057 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.