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16018-51-2 | Guanidine, N-(4-chlorophenyl)-N'-(4,6-dimethyl-2-pyrimidinyl)-
CAS No: 16018-51-2 Catalog No: AG001RQS MDL No:
Product Description
Catalog Number:
AG001RQS
Chemical Name:
Guanidine, N-(4-chlorophenyl)-N'-(4,6-dimethyl-2-pyrimidinyl)-
CAS Number:
16018-51-2
Molecular Formula:
C13H14ClN5
Molecular Weight:
275.7368
IUPAC Name:
1-(4-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)guanidine
InChI:
InChI=1S/C13H14ClN5/c1-8-7-9(2)17-13(16-8)19-12(15)18-11-5-3-10(14)4-6-11/h3-7H,1-2H3,(H3,15,16,17,18,19)
InChI Key:
ANHAWMLUXSUVCU-UHFFFAOYSA-N
SMILES:
N=C(Nc1nc(C)cc(n1)C)Nc1ccc(cc1)Cl
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
275.094g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
275.74g/mol
Monoisotopic Mass:
275.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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