吡哆胺-5-硫代乙酸氢溴酸盐
TL;DR: 吡哆胺-5-硫代乙酸氢溴酸盐 (CAS 17433-39-5) is a chemical compound with molecular formula C10H15BrN2O2S and molecular weight 306.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡哆胺-5-硫代乙酸氢溴酸盐
[5-(acetylsulfanylmethyl)-3-hydroxy-2-methyl-4-pyridinyl]methylazanium bromide
Also Known As: Pyridoxamin-5-thioacetat hydrobromid, Pyridoxamin-5-thioacetate hydrobromide, Pyridoxamin-5-thioacetat hydrobromid [German], 5-(Acetylthiomethyl)-4-aminomethyl-2-methyl-3-pyridinol hydrobromide, 4-Aminomethyl-5-mercaptomethyl-2-methyl-3-pyridinol thio acetate hydrobromide
| Molecular Formula | C10H15BrN2O2S |
|---|---|
| Molecular Weight | 306.00 g/mol |
| LogP | -2.38 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 306.00375 |
| Heavy Atoms | 16 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 17433-39-5 |
|---|---|
| SMILES | CC1=NC=C(C(=C1O)C[NH3+])CSC(=O)C.[Br-] |
| InChIKey | JGKCCMMOAZUVLK-UHFFFAOYSA-N |
Product Overview
吡哆胺-5-硫代乙酸氢溴酸盐 (CAS 17433-39-5), with molecular formula C10H15BrN2O2S and molecular weight 306.00 g/mol. IUPAC: [5-(acetylsulfanylmethyl)-3-hydroxy-2-methyl-4-pyridinyl]methylazanium bromide.
Chemical Property Profile of 吡哆胺-5-硫代乙酸氢溴酸盐
Property Insights of 吡哆胺-5-硫代乙酸氢溴酸盐
The XLogP value of -2.38 indicates that 吡哆胺-5-硫代乙酸氢溴酸盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 吡哆胺-5-硫代乙酸氢溴酸盐. Following Lipinski's Rule of Five, 吡哆胺-5-硫代乙酸氢溴酸盐 has 2 hydrogen bond donor(s) and 5 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 吡哆胺-5-硫代乙酸氢溴酸盐?
The CAS number of 吡哆胺-5-硫代乙酸氢溴酸盐 is 17433-39-5.
What is the molecular formula of 吡哆胺-5-硫代乙酸氢溴酸盐?
The molecular formula of 吡哆胺-5-硫代乙酸氢溴酸盐 is C10H15BrN2O2S.
What is the molecular weight of 吡哆胺-5-硫代乙酸氢溴酸盐?
The molecular weight of 吡哆胺-5-硫代乙酸氢溴酸盐 is 306.00 g/mol.
Where can I buy 吡哆胺-5-硫代乙酸氢溴酸盐?
You can request a quote for 吡哆胺-5-硫代乙酸氢溴酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡哆胺-5-硫代乙酸氢溴酸盐?
Yes, KEHONG BIO provides custom synthesis services for 吡哆胺-5-硫代乙酸氢溴酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.