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799-07-5 | N,4-BIS(BENZYLIDENEAMINO)-5-METHYL-1,2,4-TRIAZOL-3-AMINE
CAS No: 799-07-5 Catalog No: AG004Z9P MDL No:
Product Description
Catalog Number:
AG004Z9P
Chemical Name:
N,4-BIS(BENZYLIDENEAMINO)-5-METHYL-1,2,4-TRIAZOL-3-AMINE
CAS Number:
799-07-5
Molecular Formula:
C17H16N6
Molecular Weight:
304.3491
IUPAC Name:
N,4-bis(benzylideneamino)-5-methyl-1,2,4-triazol-3-amine
InChI:
InChI=1S/C17H16N6/c1-14-20-22-17(21-18-12-15-8-4-2-5-9-15)23(14)19-13-16-10-6-3-7-11-16/h2-13H,1H3,(H,21,22)
InChI Key:
ASFZTLPLTWOYOR-UHFFFAOYSA-N
SMILES:
Cc1nnc(n1N=Cc1ccccc1)NN=Cc1ccccc1
Properties
Complexity:
398
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.144g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
304.357g/mol
Monoisotopic Mass:
304.144g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
67.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
3.5
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