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1421263-56-0 | 4-(4'-Bromo-4-biphenylyl)-2-(3-pyridyl)thiazole
CAS No: 1421263-56-0 Catalog No: AG01F9UM MDL No:MFCD22683030
Product Description
Catalog Number:
AG01F9UM
Chemical Name:
4-(4'-Bromo-4-biphenylyl)-2-(3-pyridyl)thiazole
CAS Number:
1421263-56-0
Molecular Formula:
C20H13BrN2S
Molecular Weight:
393.2996
MDL Number:
MFCD22683030
IUPAC Name:
4-[4-(4-bromophenyl)phenyl]-2-pyridin-3-yl-1,3-thiazole
InChI:
InChI=1S/C20H13BrN2S/c21-18-9-7-15(8-10-18)14-3-5-16(6-4-14)19-13-24-20(23-19)17-2-1-11-22-12-17/h1-13H
InChI Key:
JDYTUPYDVRWTAD-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1ccc(cc1)c1csc(n1)c1cccnc1
Properties
Complexity:
391
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
391.998g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
393.302g/mol
Monoisotopic Mass:
391.998g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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