I-OMe-Tyrphostin AG 538
TL;DR: I-OMe-Tyrphostin AG 538 (CAS 1094048-77-7) is a chemical compound with molecular formula C17H12INO5 and molecular weight 436.976 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3,4-dihydroxybenzoyl)-3-(4-hydroxy-3-iodo-5-methoxyphenyl)prop-2-enenitrile
Also Known As: I-OMe-Tyrphostin AG 538, I-OMe-AG 538, 2-(3,4-dihydroxybenzoyl)-3-(4-hydroxy-3-iodo-5-methoxyphenyl)prop-2-enenitrile, 2-[(3,4-dihydroxyphenyl)-oxomethyl]-3-(4-hydroxy-3-iodo-5-methoxyphenyl)-2-propenenitrile
Technical Specifications
| Molecular Formula | C17H12INO5 |
| Molecular Weight | 436.976 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 111.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.976 Da |
| Heavy Atoms | 24 |
| Complexity | 542.0 |
| SMILES | COC1=C(C(=CC(=C1)C=C(C#N)C(=O)C2=CC(=C(C=C2)O)O)I)O |
| InChIKey | HSRMHXWCTRFVHK-UHFFFAOYSA-N |
Chemical Property Profile of I-OMe-Tyrphostin AG 538
Property Insights of I-OMe-Tyrphostin AG 538
The XLogP value of 3.2 indicates that I-OMe-Tyrphostin AG 538 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for I-OMe-Tyrphostin AG 538. Following Lipinski's Rule of Five, I-OMe-Tyrphostin AG 538 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of I-OMe-Tyrphostin AG 538?
The CAS number of I-OMe-Tyrphostin AG 538 is 1094048-77-7.
What is the molecular formula of I-OMe-Tyrphostin AG 538?
The molecular formula of I-OMe-Tyrphostin AG 538 is C17H12INO5.
What is the molecular weight of I-OMe-Tyrphostin AG 538?
The molecular weight of I-OMe-Tyrphostin AG 538 is 436.976 g/mol.
Where can I buy I-OMe-Tyrphostin AG 538?
You can request a quote for I-OMe-Tyrphostin AG 538 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for I-OMe-Tyrphostin AG 538?
Yes, CoreyChem provides custom synthesis services for I-OMe-Tyrphostin AG 538 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.