3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione
TL;DR: 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione (CAS 866151-56-6) is a chemical compound with molecular formula C11H11Cl2NS2 and molecular weight 290.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3,4-dichlorophenyl)methyl]-1,3-thiazinane-2-thione
Also Known As: 3-[(3,4-dichlorophenyl)methyl]-1,3-thiazinane-2-thione, 3-(3,4-dichlorobenzyl)-1,3-thiazinane-2-thione
| Molecular Formula | C11H11Cl2NS2 |
|---|---|
| Molecular Weight | 290.97 g/mol |
| LogP | 4.2172 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.971 |
| Heavy Atoms | 16 |
| Complexity | 408.97107 |
Chemical Identifiers
| CAS Number | 866151-56-6 |
|---|---|
| SMILES | C1CN(C(=S)SC1)CC2=CC(=C(C=C2)Cl)Cl |
Product Overview
3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione (CAS 866151-56-6), with molecular formula C11H11Cl2NS2 and molecular weight 290.97 g/mol. IUPAC: 3-[(3,4-dichlorophenyl)methyl]-1,3-thiazinane-2-thione.
Chemical Property Profile of 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione
Property Insights of 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione
The XLogP value of 4.2172 indicates that 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.24 Ų, 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione has 0 hydrogen bond donor(s) and 2 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 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione?
The CAS number of 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione is 866151-56-6.
What is the molecular formula of 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione?
The molecular formula of 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione is C11H11Cl2NS2.
What is the molecular weight of 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione?
The molecular weight of 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione is 290.97 g/mol.
Where can I buy 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione?
You can request a quote for 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3,4-Dichlorophenyl)methyl]-1,3-thiazinane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.