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Home > Imidazoles > 825616-29-3
825616-29-3 | 1H-Indole-3-acetamide, N-[3-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-
CAS No: 825616-29-3 Catalog No: AG005DWW MDL No:
Product Description
Catalog Number:
AG005DWW
Chemical Name:
1H-Indole-3-acetamide, N-[3-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-
CAS Number:
825616-29-3
Molecular Formula:
C20H16N6O
Molecular Weight:
356.3806
IUPAC Name:
N-[5-(1H-benzimidazol-2-yl)-1H-pyrazol-4-yl]-2-(1H-indol-3-yl)acetamide
InChI:
InChI=1S/C20H16N6O/c27-18(9-12-10-21-14-6-2-1-5-13(12)14)23-17-11-22-26-19(17)20-24-15-7-3-4-8-16(15)25-20/h1-8,10-11,21H,9H2,(H,22,26)(H,23,27)(H,24,25)
InChI Key:
QWZWCOLMWGZBND-UHFFFAOYSA-N
SMILES:
O=C(Cc1c[nH]c2c1cccc2)Nc1c[nH]nc1c1nc2c([nH]1)cccc2
Properties
Complexity:
545
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
356.139g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
356.389g/mol
Monoisotopic Mass:
356.139g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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