1,2,3,4-Thiatriazol-5-amine, N-(4-chlorophenyl)-

HCID 936108CAS 13078-27-8
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Basic information

Standard SMILES
Clc1ccc(Nc2nnns2)cc1
InChIKey
YFYMEIRRZFZFGO-UHFFFAOYSA-N
Molecular formula
C7H5ClN4S
Average molar mass
212.66 g/mol
Monoisotopic mass
211.99234484

Names & identifiers

Preferred name
1,2,3,4-Thiatriazol-5-amine, N-(4-chlorophenyl)-
IUPAC
N-(4-chlorophenyl)thiatriazol-5-amine

Names & synonyms

13078-27-81,2,3,4-Thiatriazol-5-amine, N-(4-chlorophenyl)-DTXSID50359075RefChem:214550DTXCID40310130N-(4-chlorophenyl)-1,2,3,4-thiatriazol-5-amineChemDiv3_006467SCHEMBL9011632HMS1491F21CCG-25395STK795113AKOS000347956
Show more names
IDI1_024377ST4106974(4-chlorophenyl)-1,2,3,4-thiatriazol-5-ylamineSR-01000104356SR-01000104356-1N-(4-CHLOROPHENYL)-N-(1,2,3,4-THIATRIAZOL-5-YL)AMINE

Database identifiers

CAS
13078-27-8
PubChem CID
936108
DTXSID
DTXSID50359075

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
78.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
13

Related reactions

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