Clorotepine, (R)-
TL;DR: Clorotepine, (R)- (CAS 41931-05-9) is a chemical compound with molecular formula C19H21ClN2S and molecular weight 344.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(5R)-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]-4-methylpiperazine
Also Known As: (-)-Clothepin, Clorotepine, (R)-, Octoclothepin, (-)-Octoclothepin, (-)-Clorotepine
| Molecular Formula | C19H21ClN2S |
|---|---|
| Molecular Weight | 344.11 g/mol |
| LogP | 4.3358 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 344.1114 |
| Heavy Atoms | 23 |
| Complexity | 710.26587 |
Chemical Identifiers
| CAS Number | 41931-05-9 |
|---|---|
| SMILES | CN1CCN(CC1)[C@@H]2CC3=CC=CC=C3SC4=C2C=C(C=C4)Cl |
Product Overview
Clorotepine, (R)- (CAS 41931-05-9), with molecular formula C19H21ClN2S and molecular weight 344.11 g/mol. IUPAC: 1-[(5R)-3-chloro-5,6-dihydrobenzo[b][1]benzothiepin-5-yl]-4-methylpiperazine.
Chemical Property Profile of Clorotepine, (R)-
Property Insights of Clorotepine, (R)-
The XLogP value of 4.3358 indicates that Clorotepine, (R)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, Clorotepine, (R)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Clorotepine, (R)- has 0 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 Clorotepine, (R)-?
The CAS number of Clorotepine, (R)- is 41931-05-9.
What is the molecular formula of Clorotepine, (R)-?
The molecular formula of Clorotepine, (R)- is C19H21ClN2S.
What is the molecular weight of Clorotepine, (R)-?
The molecular weight of Clorotepine, (R)- is 344.11 g/mol.
Where can I buy Clorotepine, (R)-?
You can request a quote for Clorotepine, (R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clorotepine, (R)-?
Yes, KEHONG BIO provides custom synthesis services for Clorotepine, (R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.