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264882-81-7 | 2-Pyrimidinamine, 4-(4-chlorophenyl)-6-(2,4-dichloro-5-fluorophenyl)-
CAS No: 264882-81-7 Catalog No: AG002TEQ MDL No:
Product Description
Catalog Number:
AG002TEQ
Chemical Name:
2-Pyrimidinamine, 4-(4-chlorophenyl)-6-(2,4-dichloro-5-fluorophenyl)-
CAS Number:
264882-81-7
Molecular Formula:
C16H9Cl3FN3
Molecular Weight:
368.6202
IUPAC Name:
4-(4-chlorophenyl)-6-(2,4-dichloro-5-fluorophenyl)pyrimidin-2-amine
InChI:
InChI=1S/C16H9Cl3FN3/c17-9-3-1-8(2-4-9)14-7-15(23-16(21)22-14)10-5-13(20)12(19)6-11(10)18/h1-7H,(H2,21,22,23)
InChI Key:
DIITXZFVUSHXFX-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nc(N)nc(c1)c1cc(F)c(cc1Cl)Cl
Properties
Complexity:
395
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.985g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
368.617g/mol
Monoisotopic Mass:
366.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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