![2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 structure](/static/products/1712/17124-80-0.webp)
2-((1H-苯并[d]咪唑-2-基)硫代)乙胺
TL;DR: 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 (CAS 17124-80-0) is a chemical compound with molecular formula C9H11N3S and molecular weight 193.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-((1H-苯并[d]咪唑-2-基)硫代)乙胺
2-(1H-benzimidazol-2-ylsulfanyl)ethanamine
Also Known As: 2-((1H-benzo[d]imidazol-2-yl)thio)ethanamine, 2-(1H-benzimidazol-2-ylsulfanyl)ethanamine, 2-benzimidazol-2-ylthioethylamine, BAS 02937058, 2-(1H-Benzoimidazol-2-ylsulfanyl)-ethylamine
| Molecular Formula | C9H11N3S |
|---|---|
| Molecular Weight | 193.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.06737 |
| Heavy Atoms | 13 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 17124-80-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)SCCN |
| InChIKey | VRYQWOHUFXJQHB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 (CAS 17124-80-0), with molecular formula C9H11N3S and molecular weight 193.07 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)ethanamine.
Chemical Property Profile of 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺
Property Insights of 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺. Following Lipinski's Rule of Five, 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 has 2 hydrogen bond donor(s) and 3 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-((1H-苯并[d]咪唑-2-基)硫代)乙胺?
The CAS number of 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 is 17124-80-0.
What is the molecular formula of 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺?
The molecular formula of 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 is C9H11N3S.
What is the molecular weight of 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺?
The molecular weight of 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 is 193.07 g/mol.
Where can I buy 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺?
You can request a quote for 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺?
Yes, KEHONG BIO provides custom synthesis services for 2-((1H-苯并[d]咪唑-2-基)硫代)乙胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.