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Home > Imidazoles > 89726-15-8
89726-15-8 | 1H-Imidazo[1,2-b]pyrazol-2(3H)-one, 6-methyl-1,3,3-triphenyl-7-propyl-
CAS No: 89726-15-8 Catalog No: AG0041IM MDL No:
Product Description
Catalog Number:
AG0041IM
Chemical Name:
1H-Imidazo[1,2-b]pyrazol-2(3H)-one, 6-methyl-1,3,3-triphenyl-7-propyl-
CAS Number:
89726-15-8
Molecular Formula:
C27H25N3O
Molecular Weight:
407.5069
IUPAC Name:
6-methyl-1,3,3-triphenyl-7-propylimidazo[1,2-b]pyrazol-2-one
InChI:
InChI=1S/C27H25N3O/c1-3-13-24-20(2)28-30-25(24)29(23-18-11-6-12-19-23)26(31)27(30,21-14-7-4-8-15-21)22-16-9-5-10-17-22/h4-12,14-19H,3,13H2,1-2H3
InChI Key:
MABDDHATWUXDKR-UHFFFAOYSA-N
SMILES:
CCCc1c(C)nn2c1N(c1ccccc1)C(=O)C2(c1ccccc1)c1ccccc1
Properties
Complexity:
600
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
407.2g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
407.517g/mol
Monoisotopic Mass:
407.2g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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