Name: Name:1H-1,2,4-Triazol-3-amine, 1-(6-chloro-4-pyrimidinyl)-
Brand: Angene
SKU: AG000RGH
Rating: 90 (10 reviews)

1H-1,2,4-Triazol-3-amine, 1-(6-chloro-4-pyrimidinyl)-

CAS No.:

1260850-75-6

Catalog Number:

AG000RGH

Molecular Formula:

C6H5ClN6

Molecular Weight:

196.5971

Catalog Number:

AG000RGH

Chemical Name:

1H-1,2,4-Triazol-3-amine, 1-(6-chloro-4-pyrimidinyl)-

CAS Number:

1260850-75-6

Molecular Formula:

C6H5ClN6

Molecular Weight:

196.5971

MDL Number:

MFCD11109850

IUPAC Name:

1-(6-chloropyrimidin-4-yl)-1,2,4-triazol-3-amine

InChI:

InChI=1S/C6H5ClN6/c7-4-1-5(10-2-9-4)13-3-11-6(8)12-13/h1-3H,(H2,8,12)

InChI Key:

XIKSHUKWERTAED-UHFFFAOYSA-N

SMILES:

Nc1ncn(n1)c1ncnc(c1)Cl

Complexity:

179

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

196.026g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

196.598g/mol

Monoisotopic Mass:

196.026g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

82.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.9