2-(1,3-Thiazol-2-yl)azepane
TL;DR: 2-(1,3-Thiazol-2-yl)azepane (CAS 527673-92-3) is a chemical compound with molecular formula C9H14N2S and molecular weight 182.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(azepan-2-yl)-1,3-thiazole
Also Known As: 2-(1,3-thiazol-2-yl)azepane, 2-(azepan-2-yl)-1,3-thiazole, 1H-Azepine, hexahydro-2-(2-thiazolyl)-
| Molecular Formula | C9H14N2S |
|---|---|
| Molecular Weight | 182.09 g/mol |
| LogP | 2.3478 |
| Topological Polar Surface Area | 24.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.08777 |
| Heavy Atoms | 12 |
| Complexity | 212.44223 |
Chemical Identifiers
| CAS Number | 527673-92-3 |
|---|---|
| SMILES | C1CCC(NCC1)C2=NC=CS2 |
Product Overview
2-(1,3-Thiazol-2-yl)azepane (CAS 527673-92-3), with molecular formula C9H14N2S and molecular weight 182.09 g/mol. IUPAC: 2-(azepan-2-yl)-1,3-thiazole.
Chemical Property Profile of 2-(1,3-Thiazol-2-yl)azepane
Property Insights of 2-(1,3-Thiazol-2-yl)azepane
The XLogP value of 2.3478 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(1,3-Thiazol-2-yl)azepane. With a topological polar surface area (TPSA) of 24.92 Ų, 2-(1,3-Thiazol-2-yl)azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1,3-Thiazol-2-yl)azepane has 1 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-(1,3-Thiazol-2-yl)azepane?
The CAS number of 2-(1,3-Thiazol-2-yl)azepane is 527673-92-3.
What is the molecular formula of 2-(1,3-Thiazol-2-yl)azepane?
The molecular formula of 2-(1,3-Thiazol-2-yl)azepane is C9H14N2S.
What is the molecular weight of 2-(1,3-Thiazol-2-yl)azepane?
The molecular weight of 2-(1,3-Thiazol-2-yl)azepane is 182.09 g/mol.
Where can I buy 2-(1,3-Thiazol-2-yl)azepane?
You can request a quote for 2-(1,3-Thiazol-2-yl)azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1,3-Thiazol-2-yl)azepane?
Yes, KEHONG BIO provides custom synthesis services for 2-(1,3-Thiazol-2-yl)azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.