(-)-Methiothepin
TL;DR: (-)-Methiothepin (CAS 101395-31-7) is a chemical compound with molecular formula C20H24N2S2 and molecular weight 356.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-[(5R)-3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine
Also Known As: methiothepin, Metitepine, (-)-Metitepine, (-)-Methiothepin, CAS-19728-88-2
| Molecular Formula | C20H24N2S2 |
|---|---|
| Molecular Weight | 356.14 g/mol |
| LogP | 4.4043 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.1381 |
| Heavy Atoms | 24 |
| Complexity | 723.32886 |
Chemical Identifiers
| CAS Number | 101395-31-7 |
|---|---|
| SMILES | CN1CCN(CC1)[C@@H]2CC3=CC=CC=C3SC4=C2C=C(C=C4)SC |
Product Overview
(-)-Methiothepin (CAS 101395-31-7), with molecular formula C20H24N2S2 and molecular weight 356.14 g/mol. IUPAC: 1-methyl-4-[(5R)-3-methylsulfanyl-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]piperazine.
Chemical Property Profile of (-)-Methiothepin
Property Insights of (-)-Methiothepin
The XLogP value of 4.4043 indicates that (-)-Methiothepin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, (-)-Methiothepin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (-)-Methiothepin 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 (-)-Methiothepin?
The CAS number of (-)-Methiothepin is 101395-31-7.
What is the molecular formula of (-)-Methiothepin?
The molecular formula of (-)-Methiothepin is C20H24N2S2.
What is the molecular weight of (-)-Methiothepin?
The molecular weight of (-)-Methiothepin is 356.14 g/mol.
Where can I buy (-)-Methiothepin?
You can request a quote for (-)-Methiothepin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (-)-Methiothepin?
Yes, KEHONG BIO provides custom synthesis services for (-)-Methiothepin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.