![2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one structure](/static/products/1992/19920-58-2.webp)
2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one
TL;DR: 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one (CAS 19920-58-2) is a chemical compound with molecular formula C8H8ClNOS and molecular weight 201.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4,5,6,7-tetrahydrothieno[2,3-c]azepin-8-one
Also Known As: 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one, 2-chloro-4,5,6,7-tetrahydrothieno[2,3-c]azepin-8-one, 2-chloro-4H,5H,6H,7H,8H-thieno[2,3-c]azepin-8-one
| Molecular Formula | C8H8ClNOS |
|---|---|
| Molecular Weight | 201.00 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 57.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 201.00151 |
| Heavy Atoms | 12 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 19920-58-2 |
|---|---|
| SMILES | C1CC2=C(C(=O)NC1)SC(=C2)Cl |
| InChIKey | RPMWYGMUJTWLJW-UHFFFAOYSA-N |
Product Overview
2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one (CAS 19920-58-2), with molecular formula C8H8ClNOS and molecular weight 201.00 g/mol. IUPAC: 2-chloro-4,5,6,7-tetrahydrothieno[2,3-c]azepin-8-one.
Chemical Property Profile of 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one
Property Insights of 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one. With a topological polar surface area (TPSA) of 57.3 Ų, 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one has 1 hydrogen bond donor(s) and 2 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-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one?
The CAS number of 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one is 19920-58-2.
What is the molecular formula of 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one?
The molecular formula of 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one is C8H8ClNOS.
What is the molecular weight of 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one?
The molecular weight of 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one is 201.00 g/mol.
Where can I buy 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one?
You can request a quote for 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-6,7-dihydro-4H-thieno[2,3-c]azepin-8(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.