![4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione structure](/static/products/866/866153-97-1.png)
4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione
TL;DR: 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione (CAS 866153-97-1) is a chemical compound with molecular formula C17H14F2N2S2 and molecular weight 348.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione
Also Known As: 4-[(benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione, 4-[(benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2(3H)-thione, 4-[(benzylamino)methyl]-3-(2,6-difluorophenyl)-2,3-dihydro-1,3-thiazole-2-thione
| Molecular Formula | C17H14F2N2S2 |
|---|---|
| Molecular Weight | 348.06 g/mol |
| LogP | 4.83629 |
| Topological Polar Surface Area | 16.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.05664 |
| Heavy Atoms | 23 |
| Complexity | 836.27997 |
Chemical Identifiers
| CAS Number | 866153-97-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNCC2=CSC(=S)N2C3=C(C=CC=C3F)F |
Product Overview
4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione (CAS 866153-97-1), with molecular formula C17H14F2N2S2 and molecular weight 348.06 g/mol. IUPAC: 4-[(benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione.
Chemical Property Profile of 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione
Property Insights of 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione
The XLogP value of 4.83629 indicates that 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 16.96 Ų, 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione has 1 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 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione?
The CAS number of 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione is 866153-97-1.
What is the molecular formula of 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione?
The molecular formula of 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione is C17H14F2N2S2.
What is the molecular weight of 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione?
The molecular weight of 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione is 348.06 g/mol.
Where can I buy 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione?
You can request a quote for 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Benzylamino)methyl]-3-(2,6-difluorophenyl)-1,3-thiazole-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.