![N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide structure](/static/products/209/20904-56-7.png)
N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide
TL;DR: N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide (CAS 20904-56-7) is a chemical compound with molecular formula C16H15NO2S and molecular weight 285.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide
Also Known As: AE-641/30102009, N-(11-hydroxy-10,11-dihydrodibenzo[b,f]thiepin-2-yl)acetamide, N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide
| Molecular Formula | C16H15NO2S |
|---|---|
| Molecular Weight | 285.08 g/mol |
| LogP | 3.3857 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.08234 |
| Heavy Atoms | 20 |
| Complexity | 669.2765 |
Chemical Identifiers
| CAS Number | 20904-56-7 |
|---|---|
| SMILES | CC(=O)NC1=CC2=C(C=C1)SC3=CC=CC=C3CC2O |
Product Overview
N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide (CAS 20904-56-7), with molecular formula C16H15NO2S and molecular weight 285.08 g/mol. IUPAC: N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide.
Chemical Property Profile of N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide
Property Insights of N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide
The XLogP value of 3.3857 indicates that N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide has 2 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 N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide?
The CAS number of N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide is 20904-56-7.
What is the molecular formula of N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide?
The molecular formula of N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide is C16H15NO2S.
What is the molecular weight of N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide?
The molecular weight of N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide is 285.08 g/mol.
Where can I buy N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide?
You can request a quote for N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-hydroxy-5,6-dihydrobenzo[b][1]benzothiepin-3-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.