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143696-99-5 | Imidazo[1,2-a]pyrimidine, 2-(4-bromophenyl)-1,5,6,7-tetrahydro-
CAS No: 143696-99-5 Catalog No: AG001I76 MDL No:
Product Description
Catalog Number:
AG001I76
Chemical Name:
Imidazo[1,2-a]pyrimidine, 2-(4-bromophenyl)-1,5,6,7-tetrahydro-
CAS Number:
143696-99-5
Molecular Formula:
C12H12BrN3
Molecular Weight:
278.1478
IUPAC Name:
2-(4-bromophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrimidine
InChI:
InChI=1S/C12H12BrN3/c13-10-4-2-9(3-5-10)11-8-16-7-1-6-14-12(16)15-11/h2-5,8H,1,6-7H2,(H,14,15)
InChI Key:
FQYJLUVFIWYCSA-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1cn2c(=NCCC2)[nH]1
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.021g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.153g/mol
Monoisotopic Mass:
277.021g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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