![2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one structure](/static/products/5480/54805-53-7.webp)
2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one
TL;DR: 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one (CAS 54805-53-7) is a chemical compound with molecular formula C15H15NOS and molecular weight 257.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one
Also Known As: 2-methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one, 2-methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-on, 2-Methyl-3-phenyl-5,6,7,8-tetrahydro-4H-thieno[2,3-b]azepin-4-one
| Molecular Formula | C15H15NOS |
|---|---|
| Molecular Weight | 257.09 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 57.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 257.08743 |
| Heavy Atoms | 18 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 54805-53-7 |
|---|---|
| SMILES | CC1=C(C2=C(S1)NCCCC2=O)C3=CC=CC=C3 |
| InChIKey | FRYTZTXYDCEQKP-UHFFFAOYSA-N |
Product Overview
2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one (CAS 54805-53-7), with molecular formula C15H15NOS and molecular weight 257.09 g/mol. IUPAC: 2-methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one.
Chemical Property Profile of 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one
Property Insights of 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one
The XLogP value of 3.8 indicates that 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.3 Ų, 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]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-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one?
The CAS number of 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one is 54805-53-7.
What is the molecular formula of 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one?
The molecular formula of 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one is C15H15NOS.
What is the molecular weight of 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one?
The molecular weight of 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one is 257.09 g/mol.
Where can I buy 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one?
You can request a quote for 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]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-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-3-phenyl-5,6,7,8-tetrahydrothieno[2,3-b]azepin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.