3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐
TL;DR: 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 (CAS 1030-84-8) is a chemical compound with molecular formula C12H20N2O4S2 and molecular weight 320.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐
4-methylbenzenesulfonic acid;3-(2-sulfanylethylamino)propanamide
Also Known As: WR 2529, 3-(2-Mercaptoethyl)aminopropionamide tosylate, Propoamide, mono-p-tolunesulfonate (salt), Propanamide, 3-((2-mercaptoethyl)amino)-, mono(4-methylbenzenesulfonate) (salt), 3-(2-Mercaptoethylamino)propionamide p-toluenesulofnate
| Molecular Formula | C12H20N2O4S2 |
|---|---|
| Molecular Weight | 320.09 g/mol |
| LogP | 0.62 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.08646 |
| Heavy Atoms | 20 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 1030-84-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.C(CNCCS)C(=O)N |
| InChIKey | VKWZCEGDRJOLKT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 (CAS 1030-84-8), with molecular formula C12H20N2O4S2 and molecular weight 320.09 g/mol. IUPAC: 4-methylbenzenesulfonic acid;3-(2-sulfanylethylamino)propanamide.
Chemical Property Profile of 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐
Property Insights of 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐
The XLogP value of 0.62 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐. Following Lipinski's Rule of Five, 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 has 4 hydrogen bond donor(s) and 6 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 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐?
The CAS number of 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 is 1030-84-8.
What is the molecular formula of 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐?
The molecular formula of 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 is C12H20N2O4S2.
What is the molecular weight of 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐?
The molecular weight of 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 is 320.09 g/mol.
Where can I buy 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐?
You can request a quote for 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-巯基乙基)氨基丙酰胺对甲苯磺酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.