1-Phenyl-5-(phenylamino)tetrazole

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Basic information

CAS: 64287-36-1
Standard SMILES: c1ccc(Nc2nnnn2-c2ccccc2)cc1
InChIKey: FJTDLZAMFPCHCY-UHFFFAOYSA-N
Molecular formula: C13H11N5
Average molar mass: 237.26 g/mol
Monoisotopic mass: 237.10144537

Names & identifiers

Preferred name: 1-Phenyl-5-(phenylamino)tetrazole
IUPAC: N,1-diphenyltetrazol-5-amine

Names & synonyms

N,1-Diphenyl-1H-tetraazol-5-amine64287-36-1DQH89UJD6XUNII-DQH89UJD6X1-Phenyl-5-(phenylamino)tetrazoleNSC 338121NSC-338121N,1-DIPHENYL-1H-TETRAZOL-5-AMINEDTXSID602145051H-Tetrazol-5-amine, N,1-diphenyl-1H-TETRAZOLE, 5-ANILINO-1-PHENYL-RefChem:197091

Show more names

DTXCID20136996N,1-diphenyltetrazol-5-amineNSC338121SCHEMBL8507647CHEMBL5182547FJTDLZAMFPCHCY-UHFFFAOYSA-NN,1-Diphenyl-1H-tetraazol-5-amine #1-Phenyl-5-(phenylamino)(1H)tetrazole

Database identifiers

CAS: 64287-36-1
PubChem CID: 333963
DTXSID: DTXSID60214505
ChEMBL: CHEMBL5182547
UNII: DQH89UJD6X
Nikkaji: J2.964.390C

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 55.6 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 18
Formal charge: 0
Complexity: 248

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Compound notes

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