3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone
TL;DR: 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone (CAS 400075-89-0) is a chemical compound with molecular formula C12H6Cl2N2OS and molecular weight 295.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5,6-dichloro-1,3-benzothiazol-2-yl)-1H-pyridin-2-one
Also Known As: 11J-311S, 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone, 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-1H-pyridin-2-one, 3-(5,6-dichloro-3H-1,3-benzothiazol-2-ylidene)pyridin-2-one, 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-1,2-dihydropyridin-2-one
| Molecular Formula | C12H6Cl2N2OS |
|---|---|
| Molecular Weight | 295.96 g/mol |
| LogP | 3.9584 |
| Topological Polar Surface Area | 45.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 295.9578 |
| Heavy Atoms | 18 |
| Complexity | 755.1169 |
Chemical Identifiers
| CAS Number | 400075-89-0 |
|---|---|
| SMILES | C1=CNC(=O)C(=C1)C2=NC3=CC(=C(C=C3S2)Cl)Cl |
Product Overview
3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone (CAS 400075-89-0), with molecular formula C12H6Cl2N2OS and molecular weight 295.96 g/mol. IUPAC: 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-1H-pyridin-2-one.
Chemical Property Profile of 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone
Property Insights of 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone
The XLogP value of 3.9584 indicates that 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.75 Ų, 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone 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 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone?
The CAS number of 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone is 400075-89-0.
What is the molecular formula of 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone?
The molecular formula of 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone is C12H6Cl2N2OS.
What is the molecular weight of 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone?
The molecular weight of 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone is 295.96 g/mol.
Where can I buy 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone?
You can request a quote for 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone?
Yes, KEHONG BIO provides custom synthesis services for 3-(5,6-dichloro-1,3-benzothiazol-2-yl)-2(1H)-pyridinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.