![2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one structure](/static/products/304/30481-27-7.png)
2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one
TL;DR: 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one (CAS 30481-27-7) is a chemical compound with molecular formula C16H14O3S and molecular weight 286.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one
Also Known As: 7,8-dimethoxydibenzo[b,f]thiepin-10(11H)-one, 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one, AE-641/30101047
| Molecular Formula | C16H14O3S |
|---|---|
| Molecular Weight | 286.07 g/mol |
| LogP | 3.5938 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.06638 |
| Heavy Atoms | 20 |
| Complexity | 679.41736 |
Chemical Identifiers
| CAS Number | 30481-27-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C(=O)CC3=CC=CC=C3S2)OC |
Product Overview
2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one (CAS 30481-27-7), with molecular formula C16H14O3S and molecular weight 286.07 g/mol. IUPAC: 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one.
Chemical Property Profile of 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one
Property Insights of 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one
The XLogP value of 3.5938 indicates that 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one has 0 hydrogen bond donor(s) and 4 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 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one?
The CAS number of 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one is 30481-27-7.
What is the molecular formula of 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one?
The molecular formula of 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one is C16H14O3S.
What is the molecular weight of 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one?
The molecular weight of 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one is 286.07 g/mol.
Where can I buy 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one?
You can request a quote for 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2,3-dimethoxy-6H-benzo[b][1]benzothiepin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.