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81891-75-0 | Pyridine, 3-[2-(2,2-dimethoxyethyl)-5-phenyl-1H-imidazol-4-yl]-
CAS No: 81891-75-0 Catalog No: AG005673 MDL No:
Product Description
Catalog Number:
AG005673
Chemical Name:
Pyridine, 3-[2-(2,2-dimethoxyethyl)-5-phenyl-1H-imidazol-4-yl]-
CAS Number:
81891-75-0
Molecular Formula:
C18H19N3O2
Molecular Weight:
309.3624
IUPAC Name:
3-[2-(2,2-dimethoxyethyl)-5-phenyl-1H-imidazol-4-yl]pyridine
InChI:
InChI=1S/C18H19N3O2/c1-22-16(23-2)11-15-20-17(13-7-4-3-5-8-13)18(21-15)14-9-6-10-19-12-14/h3-10,12,16H,11H2,1-2H3,(H,20,21)
InChI Key:
ANTQKDKVWRBAEW-UHFFFAOYSA-N
SMILES:
COC(Cc1nc(c([nH]1)c1ccccc1)c1cccnc1)OC
Properties
Complexity:
345
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.148g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
309.369g/mol
Monoisotopic Mass:
309.148g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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