1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-
TL;DR: 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- (CAS 6525-45-7) is a chemical compound with molecular formula C12H11Cl2N3OS and molecular weight 315.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dichlorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one
Also Known As: 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-, 2-(3,4-dichlorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one, 1H-[1,2,4]Triazolo[1,2-a]pyridazin-1-one,2-(3,4-dichlorophenyl)hexahydro-3-thioxo-, 2-(3,4-dichloro-phenyl)-3-thioxo-hexahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one, 2-(3,4-Dichlorophenyl)-3-sulfanylidenehexahydro-1H-[1,2,4]triazolo[1,2-a]pyridazin-1-one
| Molecular Formula | C12H11Cl2N3OS |
|---|---|
| Molecular Weight | 315.00 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 315.0 |
| Heavy Atoms | 19 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 6525-45-7 |
|---|---|
| SMILES | C1CCN2C(=S)N(C(=O)N2C1)C3=CC(=C(C=C3)Cl)Cl |
| InChIKey | RNLBERRKPHJMAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- (CAS 6525-45-7), with molecular formula C12H11Cl2N3OS and molecular weight 315.00 g/mol. IUPAC: 2-(3,4-dichlorophenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one.
Chemical Property Profile of 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-
Property Insights of 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-
The XLogP value of 3.4 indicates that 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.9 Ų, 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- 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 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-?
The CAS number of 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- is 6525-45-7.
What is the molecular formula of 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-?
The molecular formula of 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- is C12H11Cl2N3OS.
What is the molecular weight of 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-?
The molecular weight of 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- is 315.00 g/mol.
Where can I buy 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-?
You can request a quote for 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 1H-(1,2,4)Triazolo(1,2-a)pyridazin-1-one, 2-(3,4-dichlorophenyl)hexahydro-3-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.