Basic information
- Standard SMILES
Cc1ccc(Nc2nnns2)cc1- InChIKey
DRCBZLVTEZFGJZ-UHFFFAOYSA-N- Molecular formula
- C8H8N4S
- Average molar mass
- 192.24 g/mol
- Monoisotopic mass
- 192.04696726
Names & identifiers
- Preferred name
- N-(4-methylphenyl)-1,2,3,4-thiatriazol-5-amine
- IUPAC
- N-(4-methylphenyl)thiatriazol-5-amine
Names & synonyms
N-(4-methylphenyl)-1,2,3,4-thiatriazol-5-amine13078-28-9ST4106975N-(4-methylphenyl)thiatriazol-5-amineMaybridge3_0042295-p-tolylaminothiatriazoleOprea1_114537MLS000519432CHEMBL1456034DTXSID00353341HMS1443A05HMS2179C13
Show more names
CCG-25396STK795550AKOS000347957IDI1_015616SMR000129851(4-methylphenyl)-1,2,3,4-thiatriazol-5-ylamineSR-01000633738-1N-(4-methylphenyl)-N-(1,2,3,4-thiatriazol-5-yl)amine
Database identifiers
- CAS
13078-28-9- PubChem CID
- 738490
- DTXSID
DTXSID00353341- ChEMBL
CHEMBL1456034- Nikkaji
- J339.808K
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 78.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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