Cysteinylglycine TFA
TL;DR: Cysteinylglycine TFA (CAS 1100364-95-1) is a chemical compound with molecular formula C28H22N4O4S and molecular weight 510.13617 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[3-cyano-6-(4-methylphenyl)-4-phenyl-2-pyridinyl]sulfanyl]-N-(4-methoxy-2-nitrophenyl)acetamide
Also Known As: Cysteinylglycine TFA, BAS 01248089, 2-((3-Cyano-4-phenyl-6-(p-tolyl)pyridin-2-yl)thio)-N-(4-methoxy-2-nitrophenyl)acetamide, 2-(3-Cyano-4-phenyl-6-p-tolyl-pyridin-2-ylsulfanyl)-N-(4-methoxy-2-nitro-phenyl)-acetamide, 2-[3-cyano-6-(4-methylphenyl)-4-phenylpyridin-2-yl]sulfanyl-N-(4-methoxy-2-nitrophenyl)acetamide
Technical Specifications
| Molecular Formula | C28H22N4O4S |
| Molecular Weight | 510.13617 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 146.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 510.13617 Da |
| Heavy Atoms | 37 |
| Complexity | 815.0 |
| 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)OC)[N+](=O)[O-] |
| InChIKey | JKWXQBXVXJOUJS-UHFFFAOYSA-N |
Chemical Property Profile of Cysteinylglycine TFA
Property Insights of Cysteinylglycine TFA
The XLogP value of 6.3 indicates that Cysteinylglycine TFA is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 146.0 Ų indicates high polarity, suggesting Cysteinylglycine TFA may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cysteinylglycine TFA has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Cysteinylglycine TFA?
The CAS number of Cysteinylglycine TFA is 1100364-95-1.
What is the molecular formula of Cysteinylglycine TFA?
The molecular formula of Cysteinylglycine TFA is C28H22N4O4S.
What is the molecular weight of Cysteinylglycine TFA?
The molecular weight of Cysteinylglycine TFA is 510.13617 g/mol.
Where can I buy Cysteinylglycine TFA?
You can request a quote for Cysteinylglycine TFA directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cysteinylglycine TFA?
Yes, CoreyChem provides custom synthesis services for Cysteinylglycine TFA and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.