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Home > Indoles and Oxindole > 827316-85-8
827316-85-8 | 1H-Indole-5-carboxamide, N-(2-furanylmethyl)-2-(1H-pyrazol-3-yl)-
CAS No: 827316-85-8 Catalog No: AG0058QT MDL No:
Product Description
Catalog Number:
AG0058QT
Chemical Name:
1H-Indole-5-carboxamide, N-(2-furanylmethyl)-2-(1H-pyrazol-3-yl)-
CAS Number:
827316-85-8
Molecular Formula:
C17H14N4O2
Molecular Weight:
306.3187
IUPAC Name:
N-(furan-2-ylmethyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide
InChI:
InChI=1S/C17H14N4O2/c22-17(18-10-13-2-1-7-23-13)11-3-4-14-12(8-11)9-16(20-14)15-5-6-19-21-15/h1-9,20H,10H2,(H,18,22)(H,19,21)
InChI Key:
RZDISZRLHHIISM-UHFFFAOYSA-N
SMILES:
O=C(c1ccc2c(c1)cc([nH]2)c1cc[nH]n1)NCc1ccco1
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.112g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
306.325g/mol
Monoisotopic Mass:
306.112g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
86.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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