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Home > Indoles and Oxindole > 827316-73-4
827316-73-4 | 1H-Indole-4-carboxamide, N-(2-methylpropyl)-2-(1H-pyrazol-3-yl)-
CAS No: 827316-73-4 Catalog No: AG00501O MDL No:
Product Description
Catalog Number:
AG00501O
Chemical Name:
1H-Indole-4-carboxamide, N-(2-methylpropyl)-2-(1H-pyrazol-3-yl)-
CAS Number:
827316-73-4
Molecular Formula:
C16H18N4O
Molecular Weight:
282.3403
IUPAC Name:
N-(2-methylpropyl)-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide
InChI:
InChI=1S/C16H18N4O/c1-10(2)9-17-16(21)11-4-3-5-13-12(11)8-15(19-13)14-6-7-18-20-14/h3-8,10,19H,9H2,1-2H3,(H,17,21)(H,18,20)
InChI Key:
QWKWKUWWUMCXNE-UHFFFAOYSA-N
SMILES:
CC(CNC(=O)c1cccc2c1cc([nH]2)c1n[nH]cc1)C
Properties
Complexity:
373
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.148g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
282.347g/mol
Monoisotopic Mass:
282.148g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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