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208187-99-9 | Pyridine, 4-[2-(4-chlorophenyl)-5-(3-phenoxyphenyl)-1H-imidazol-4-yl]-
CAS No: 208187-99-9 Catalog No: AG002JKB MDL No:
Product Description
Catalog Number:
AG002JKB
Chemical Name:
Pyridine, 4-[2-(4-chlorophenyl)-5-(3-phenoxyphenyl)-1H-imidazol-4-yl]-
CAS Number:
208187-99-9
Molecular Formula:
C26H18ClN3O
Molecular Weight:
423.8936
IUPAC Name:
4-[2-(4-chlorophenyl)-4-(3-phenoxyphenyl)-1H-imidazol-5-yl]pyridine
InChI:
InChI=1S/C26H18ClN3O/c27-21-11-9-19(10-12-21)26-29-24(18-13-15-28-16-14-18)25(30-26)20-5-4-8-23(17-20)31-22-6-2-1-3-7-22/h1-17H,(H,29,30)
InChI Key:
KWBJZWKTXONOQI-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nc(c([nH]1)c1cccc(c1)Oc1ccccc1)c1ccncc1
Properties
Complexity:
543
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
423.114g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
423.9g/mol
Monoisotopic Mass:
423.114g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.1
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