6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one
TL;DR: 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one (CAS 25465-57-0) is a chemical compound with molecular formula C8H5Cl2N3O and molecular weight 228.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,8-dichloro-3-methyl-1,2,3-benzotriazin-4-one
Also Known As: 6K-669S, 6,8-dichloro-3-methyl-3,4-dihydro-1,2,3-benzotriazin-4-one, 6,8-dichloro-3-methyl-1,2,3-benzotriazin-4-one, 6,8-dichloro-3-methyl-1,2,3-benzotriazin-4(3H)-one, 3,5-dichloro-9-methyl-7,8,9-triazabicyclo[4.4.0]deca-2,4,7,11-tetraen-10-one
| Molecular Formula | C8H5Cl2N3O |
|---|---|
| Molecular Weight | 228.98 g/mol |
| LogP | 1.6353 |
| Topological Polar Surface Area | 47.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.98097 |
| Heavy Atoms | 14 |
| Complexity | 564.2503 |
Chemical Identifiers
| CAS Number | 25465-57-0 |
|---|---|
| SMILES | CN1C(=O)C2=C(C(=CC(=C2)Cl)Cl)N=N1 |
Product Overview
6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one (CAS 25465-57-0), with molecular formula C8H5Cl2N3O and molecular weight 228.98 g/mol. IUPAC: 6,8-dichloro-3-methyl-1,2,3-benzotriazin-4-one.
Chemical Property Profile of 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one
Property Insights of 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one
The XLogP value of 1.6353 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one. With a topological polar surface area (TPSA) of 47.78 Ų, 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one 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 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one?
The CAS number of 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one is 25465-57-0.
What is the molecular formula of 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one?
The molecular formula of 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one is C8H5Cl2N3O.
What is the molecular weight of 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one?
The molecular weight of 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one is 228.98 g/mol.
Where can I buy 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one?
You can request a quote for 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 6,8-Dichloro-3-methyl-1,2,3-benzotriazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.