![2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one structure](/static/products/3302/330203-56-0.webp)
2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one
TL;DR: 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one (CAS 330203-56-0) is a chemical compound with molecular formula C9H11ClN2OS and molecular weight 230.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-7,7-dimethyl-6,8-dihydro-5H-[1,3]thiazolo[5,4-c]azepin-4-one
Also Known As: 2-Chloro-7,7-dimethyl-5,6,7,8-tetrahydro-thiazolo[5,4-c]azepin-4-one, 2-chloro-7,7-dimethyl-4H,5H,6H,7H,8H-[1,3]thiazolo[5,4-c]azepin-4-one, 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one, 2-Chloro-7,7-dimethyl-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[5,4-c]azepin-4-one, 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo(5,4-c)azepin-4-one
| Molecular Formula | C9H11ClN2OS |
|---|---|
| Molecular Weight | 230.03 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 230.02806 |
| Heavy Atoms | 14 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 330203-56-0 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)NC1)SC(=N2)Cl)C |
| InChIKey | ULTZNUMRCLUWDT-UHFFFAOYSA-N |
Product Overview
2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one (CAS 330203-56-0), with molecular formula C9H11ClN2OS and molecular weight 230.03 g/mol. IUPAC: 2-chloro-7,7-dimethyl-6,8-dihydro-5H-[1,3]thiazolo[5,4-c]azepin-4-one.
Chemical Property Profile of 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one
Property Insights of 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one. Following Lipinski's Rule of Five, 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one 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-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one?
The CAS number of 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one is 330203-56-0.
What is the molecular formula of 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one?
The molecular formula of 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one is C9H11ClN2OS.
What is the molecular weight of 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one?
The molecular weight of 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one is 230.03 g/mol.
Where can I buy 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one?
You can request a quote for 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-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-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5,6,7,8-tetrahydro-7,7-dimethyl-4H-thiazolo[5,4-c]azepin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.