酪氨酸磷酸化抑制剂AG 825
TL;DR: 酪氨酸磷酸化抑制剂AG 825 (CAS 149092-50-2) is a chemical compound with molecular formula C19H15N3O3S2 and molecular weight 397.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
酪氨酸磷酸化抑制剂AG 825
3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-hydroxy-5-methoxyphenyl]-2-cyanoprop-2-enamide
Also Known As: Tyrphostin AG 825, tyrphostin AG825, Tyrphostin AG-825, AG 825, KBio2_000522
| Molecular Formula | C19H15N3O3S2 |
|---|---|
| Molecular Weight | 397.06 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 163.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 397.05548 |
| Heavy Atoms | 27 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 149092-50-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1O)CSC2=NC3=CC=CC=C3S2)C=C(C#N)C(=O)N |
| InChIKey | KXDONFLNGBQLTN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
酪氨酸磷酸化抑制剂AG 825 (CAS 149092-50-2), with molecular formula C19H15N3O3S2 and molecular weight 397.06 g/mol. IUPAC: 3-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-hydroxy-5-methoxyphenyl]-2-cyanoprop-2-enamide.
Chemical Property Profile of 酪氨酸磷酸化抑制剂AG 825
Property Insights of 酪氨酸磷酸化抑制剂AG 825
The XLogP value of 3.6 indicates that 酪氨酸磷酸化抑制剂AG 825 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 163.0 Ų indicates high polarity, suggesting 酪氨酸磷酸化抑制剂AG 825 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 酪氨酸磷酸化抑制剂AG 825 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 酪氨酸磷酸化抑制剂AG 825?
The CAS number of 酪氨酸磷酸化抑制剂AG 825 is 149092-50-2.
What is the molecular formula of 酪氨酸磷酸化抑制剂AG 825?
The molecular formula of 酪氨酸磷酸化抑制剂AG 825 is C19H15N3O3S2.
What is the molecular weight of 酪氨酸磷酸化抑制剂AG 825?
The molecular weight of 酪氨酸磷酸化抑制剂AG 825 is 397.06 g/mol.
Where can I buy 酪氨酸磷酸化抑制剂AG 825?
You can request a quote for 酪氨酸磷酸化抑制剂AG 825 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 酪氨酸磷酸化抑制剂AG 825?
Yes, KEHONG BIO provides custom synthesis services for 酪氨酸磷酸化抑制剂AG 825 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.