Cas no 68161-58-0 (5-(3-Methoxyphenyl)amino-1,3,4-thiadiazole-2-thiol)
5-(3-Methoxyphenyl)amino-1,3,4-thiadiazole-2-thiol is a heterocyclic compound featuring a 1,3,4-thiadiazole core substituted with a 3-methoxyphenylamino group and a thiol moiety. This structure imparts unique reactivity, making it a valuable intermediate in organic synthesis and pharmaceutical research. The thiadiazole ring system is known for its biological activity, and the presence of the thiol group enhances its potential for further functionalization. The methoxyphenyl substituent contributes to its solubility and electronic properties, facilitating applications in medicinal chemistry, particularly as a precursor for bioactive molecules. Its stability and well-defined chemical behavior make it suitable for controlled synthetic processes.
68161-58-0 structure
Product Name:5-(3-Methoxyphenyl)amino-1,3,4-thiadiazole-2-thiol
CAS No:68161-58-0
MF:C9H9N3OS2
MW:239.31725859642
CID:526755
PubChem ID:708541
Update Time:2025-11-02
5-(3-Methoxyphenyl)amino-1,3,4-thiadiazole-2-thiol Chemical and Physical Properties
Names and Identifiers
-
- 1,3,4-Thiadiazole-2(3H)-thione,5-[(3-methoxyphenyl)amino]-
- 5-(3-methoxyanilino)-3H-1,3,4-thiadiazole-2-thione
- 5-[(3-METHOXYPHENYL)AMINO]-1,3,4-THIADIAZOLE-2-THIOL
- AKOS001037627
- EN300-10247
- 5-[(3-methoxyphenyl)amino]-3H-1,3,4-thiadiazole-2-thione
- Z57000618
- Oprea1_049164
- BDBM44063
- CHEMBL1344163
- HMS561L06
- 5-(m-anisidino)-3H-1,3,4-thiadiazole-2-thione
- 5-((3-Methoxyphenyl)amino)-1,3,4-thiadiazole-2-thiol
- DTXSID10351757
- cid_708541
- HMS2552I15
- 68161-58-0
- 5-(3-Methoxyanilino)-1,3,4-thiadiazole-2(3H)-thione
- SMR000259638
- MLS000390599
- Maybridge1_007112
- 5-(3-Methoxyphenyl)amino-1,3,4-thiadiazole-2-thiol
-
- MDL： MFCD00174866
- Inchi： 1S/C9H9N3OS2/c1-13-7-4-2-3-6(5-7)10-8-11-12-9(14)15-8/h2-5H,1H3,(H,10,11)(H,12,14)
- InChI Key： ONDKHRAMZDCFFC-UHFFFAOYSA-N
- SMILES： S1C(NN=C1NC1C=CC=C(C=1)OC)=S
Computed Properties
- Exact Mass: 239.018703
- Monoisotopic Mass: 239.018703
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 283
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 103
- XLogP3: 2.3
Experimental Properties
- Density: 1.46
- Boiling Point: 354.4°Cat760mmHg
- Flash Point: 168.2°C
- Refractive Index: 1.718
5-(3-Methoxyphenyl)amino-1,3,4-thiadiazole-2-thiol Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | M229253-25mg |
5-[(3-Methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 25mg |
$ 50.00 | 2022-06-04 | ||
| TRC | M229253-50mg |
5-[(3-Methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 50mg |
$ 70.00 | 2022-06-04 | ||
| TRC | M229253-250mg |
5-[(3-Methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 250mg |
$ 275.00 | 2022-06-04 | ||
| Chemenu | CM523963-1g |
5-((3-Methoxyphenyl)amino)-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 97% | 1g |
$*** | 2023-05-29 | |
| Enamine | EN300-10247-0.05g |
5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 95.0% | 0.05g |
$53.0 | 2025-03-21 | |
| Enamine | EN300-10247-0.1g |
5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 95.0% | 0.1g |
$83.0 | 2025-03-21 | |
| Enamine | EN300-10247-0.25g |
5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 95.0% | 0.25g |
$116.0 | 2025-03-21 | |
| Enamine | EN300-10247-0.5g |
5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 95.0% | 0.5g |
$218.0 | 2025-03-21 | |
| Enamine | EN300-10247-1.0g |
5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 95.0% | 1.0g |
$314.0 | 2025-03-21 | |
| Enamine | EN300-10247-2.5g |
5-[(3-methoxyphenyl)amino]-1,3,4-thiadiazole-2-thiol |
68161-58-0 | 95.0% | 2.5g |
$614.0 | 2025-03-21 |
5-(3-Methoxyphenyl)amino-1,3,4-thiadiazole-2-thiol Related Literature
-
Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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