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Home > Indoles and Oxindole > 827318-36-5
827318-36-5 | Benzeneacetamide, N-[2-(1H-pyrazol-4-yl)-1H-indol-5-yl]-
CAS No: 827318-36-5 Catalog No: AG0058Q5 MDL No:
Product Description
Catalog Number:
AG0058Q5
Chemical Name:
Benzeneacetamide, N-[2-(1H-pyrazol-4-yl)-1H-indol-5-yl]-
CAS Number:
827318-36-5
Molecular Formula:
C19H16N4O
Molecular Weight:
316.3565
IUPAC Name:
2-phenyl-N-[2-(1H-pyrazol-4-yl)-1H-indol-5-yl]acetamide
InChI:
InChI=1S/C19H16N4O/c24-19(8-13-4-2-1-3-5-13)22-16-6-7-17-14(9-16)10-18(23-17)15-11-20-21-12-15/h1-7,9-12,23H,8H2,(H,20,21)(H,22,24)
InChI Key:
VTMVTBKZVSEESX-UHFFFAOYSA-N
SMILES:
O=C(Cc1ccccc1)Nc1ccc2c(c1)cc([nH]2)c1c[nH]nc1
Properties
Complexity:
437
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.132g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
316.364g/mol
Monoisotopic Mass:
316.132g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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