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Home > Imidazoles > 111908-95-3
111908-95-3 | 5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro-2-(4-methoxyphenyl)-3-(4-pyridinyl)-
CAS No: 111908-95-3 Catalog No: AG00840Q MDL No:
Product Description
Catalog Number:
AG00840Q
Chemical Name:
5H-Pyrrolo[1,2-a]imidazole,6,7-dihydro-2-(4-methoxyphenyl)-3-(4-pyridinyl)-
CAS Number:
111908-95-3
Molecular Formula:
C18H17N3O
Molecular Weight:
291.3471
IUPAC Name:
2-(4-methoxyphenyl)-3-pyridin-4-yl-6,7-dihydro-5H-pyrrolo[1,2-a]imidazole
InChI:
InChI=1S/C18H17N3O/c1-22-15-6-4-13(5-7-15)17-18(14-8-10-19-11-9-14)21-12-2-3-16(21)20-17/h4-11H,2-3,12H2,1H3
InChI Key:
UIJWMSUSZQORDJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1nc2n(c1c1ccncc1)CCC2
Properties
Complexity:
363
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.137g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.354g/mol
Monoisotopic Mass:
291.137g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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