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2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-phenylacetamide

HCID 698762
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
332114-16-6
Standard SMILES
Nc1nnc(SCC(=O)Nc2ccccc2)s1
InChIKey
LZIITYOJDOSNHT-UHFFFAOYSA-N
Molecular formula
C10H10N4OS2
Average molar mass
266.3 g/mol
Monoisotopic mass
266.0296033

Names & identifiers

Preferred name
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-phenylacetamide
IUPAC
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-phenylacetamide
English name
2-(5-Amino-[1,3,4]thiadiazol-2-ylsulfanyl)-N-phenyl-acetamide
Molecular formula
C10H10N4OS2
Molecular weight
266.34

Names & synonyms

332114-16-62-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-phenylacetamide2-((5-Amino-1,3,4-thiadiazol-2-yl)thio)-N-phenylacetamide2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-n-phenylacetamide2-(5-Amino-[1,3,4]thiadiazol-2-ylsulfanyl)-N-phenyl-acetamide2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-phenyl-acetamideOprea1_429383Oprea1_491533MLS000769214CHEMBL1569875SCHEMBL133354202-(5-amino-1,3,4-thiadiazol-2-ylthio)-N-phenylacetamide
Show more names
acetamide, 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-N-phenyAcetamide, 2-[(5-amino-1,3,4-thiadiazol-2-yl)thio]-N-phenyl-
DTXSID901329200HMS1799E14HMS2793J09CCG-59622STK803029AKOS000112091WAY-299490NCGC00099707-01

Database identifiers

CAS
332114-16-6

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
134 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
261

Experimental & physicochemical properties

Solubility23.7 [ug/mL] (The mean of the results at pH 7.4)

Physicochemical properties

HazardClass
IRRITANT

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hazard_class
IRRITANT

Chemistry & industry

Suppliers1 total

武汉凯威斯科技有限公司86-027-67849912 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
PubChem CID
698762
DTXSID
DTXSID901329200
ChEMBL
CHEMBL1569875