N-[5-(Methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide

HCID 351890CAS 38583-51-6
Substructure searchFind similar structures

Basic information

Standard SMILES
CSc1nnc(NC(C)=O)s1
InChIKey
MOQNHXGAGXWLLU-UHFFFAOYSA-N
Molecular formula
C5H7N3OS2
Average molar mass
189.3 g/mol
Monoisotopic mass
189.00305384

Names & identifiers

Preferred name
N-[5-(Methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
IUPAC
N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
English name
N-[5-(methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
Molecular formula
C5H7N3OS2
Molecular weight
189.26

Names & synonyms

38583-51-6N-(5-(methylthio)-1,3,4-thiadiazol-2-yl)acetamideN-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)acetamideN-[5-(Methylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamideN-[5-(Methylthio)-1,3,4-thiadiazol-2-yl]acetamideNSC-523936NSC523936495DCN9AFSMethyl 5-acetamido-1,3,4-thiadiazol-2-yl sulfideSCHEMBL8779354SCHEMBL9086956Acetamide, N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]-
Show more names
DTXSID40326099MOQNHXGAGXWLLU-UHFFFAOYSA-NMFCD02182966STK724228AKOS002313681SY368968DB-298470ST45237489

Database identifiers

CAS
38583-51-6
PubChem CID
351890
DTXSID
DTXSID40326099
UNII
495DCN9AFS
Nikkaji
J1.524.520D

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
108 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

Melting point
208 · 208-209 °C(Solv: ethanol (64-17-5))
Density
1.41 · 1.41±0.1 g/cm3(Predicted)
pka
9.18 · 9.18±0.50(Predicted)

Chemistry & industry

Applications

UsesN-(5-Methylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide has potential to display antidepressant and anxiolytic activity.

Suppliers6 total

上海陶素生化科技有限公司021-33632979 · [email protected]
济宁一泽医药科技有限公司15192473210 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]

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