![3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione structure](/static/products/6406/64067-76-1.webp)
3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione
TL;DR: 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione (CAS 64067-76-1) is a chemical compound with molecular formula C11H12ClNS2 and molecular weight 257.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-chlorophenyl)methyl]-1,3-thiazinane-2-thione
Also Known As: 3-[(4-chlorophenyl)methyl]-1,3-thiazinane-2-thione, 3-[ methyl]-1,3-thiazinane-2-thione, 3-(4-chloro-benzyl)-[1,3]thiazinane-2-thione
| Molecular Formula | C11H12ClNS2 |
|---|---|
| Molecular Weight | 257.01 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 60.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.00998 |
| Heavy Atoms | 15 |
| Complexity | 227.0 |
Chemical Identifiers
| CAS Number | 64067-76-1 |
|---|---|
| SMILES | C1CN(C(=S)SC1)CC2=CC=C(C=C2)Cl |
| InChIKey | OTPBDTNXCZFCPV-UHFFFAOYSA-N |
Product Overview
3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione (CAS 64067-76-1), with molecular formula C11H12ClNS2 and molecular weight 257.01 g/mol. IUPAC: 3-[(4-chlorophenyl)methyl]-1,3-thiazinane-2-thione.
Chemical Property Profile of 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione
Property Insights of 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione
The XLogP value of 3.5 indicates that 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione. Following Lipinski's Rule of Five, 3-[(4-Chlorophenyl)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-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione?
The CAS number of 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione is 64067-76-1.
What is the molecular formula of 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione?
The molecular formula of 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione is C11H12ClNS2.
What is the molecular weight of 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione?
The molecular weight of 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione is 257.01 g/mol.
Where can I buy 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione?
You can request a quote for 3-[(4-Chlorophenyl)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-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Chlorophenyl)methyl]-1,3-thiazinane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.