2-Methylamino-5-thiazolyl thiocyanate
TL;DR: 2-Methylamino-5-thiazolyl thiocyanate (CAS 88511-70-0) is a chemical compound with molecular formula C5H5N3S2 and molecular weight 170.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(methylamino)-1,3-thiazol-5-yl] thiocyanate
Also Known As: 2-Methylamino-5-thiazolyl thiocyanate, N-Methyl-5-thiocyanatothiazole-2-amine, J1.397.636H, Thiocyanic acid, 2-(methylamino)-5-thiazolyl ester, [2-(methylamino)-1,3-thiazol-5-yl] thiocyanate
| Molecular Formula | C5H5N3S2 |
|---|---|
| Molecular Weight | 170.99 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.9925 |
| Heavy Atoms | 10 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 88511-70-0 |
|---|---|
| SMILES | CNC1=NC=C(S1)SC#N |
| InChIKey | BTURMJWXOADGPD-UHFFFAOYSA-N |
Product Overview
2-Methylamino-5-thiazolyl thiocyanate (CAS 88511-70-0), with molecular formula C5H5N3S2 and molecular weight 170.99 g/mol. IUPAC: [2-(methylamino)-1,3-thiazol-5-yl] thiocyanate.
Chemical Property Profile of 2-Methylamino-5-thiazolyl thiocyanate
Property Insights of 2-Methylamino-5-thiazolyl thiocyanate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylamino-5-thiazolyl thiocyanate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methylamino-5-thiazolyl thiocyanate. Following Lipinski's Rule of Five, 2-Methylamino-5-thiazolyl thiocyanate has 1 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 2-Methylamino-5-thiazolyl thiocyanate?
The CAS number of 2-Methylamino-5-thiazolyl thiocyanate is 88511-70-0.
What is the molecular formula of 2-Methylamino-5-thiazolyl thiocyanate?
The molecular formula of 2-Methylamino-5-thiazolyl thiocyanate is C5H5N3S2.
What is the molecular weight of 2-Methylamino-5-thiazolyl thiocyanate?
The molecular weight of 2-Methylamino-5-thiazolyl thiocyanate is 170.99 g/mol.
Where can I buy 2-Methylamino-5-thiazolyl thiocyanate?
You can request a quote for 2-Methylamino-5-thiazolyl thiocyanate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylamino-5-thiazolyl thiocyanate?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylamino-5-thiazolyl thiocyanate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.