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Home > Indoles and Oxindole > 827317-59-9
827317-59-9 | 1H-Indole-4-carboxamide, N-(1-methylethyl)-2-(1H-pyrazol-3-yl)-
CAS No: 827317-59-9 Catalog No: AG0058QD MDL No:
Product Description
Catalog Number:
AG0058QD
Chemical Name:
1H-Indole-4-carboxamide, N-(1-methylethyl)-2-(1H-pyrazol-3-yl)-
CAS Number:
827317-59-9
Molecular Formula:
C15H16N4O
Molecular Weight:
268.3137
IUPAC Name:
N-propan-2-yl-2-(1H-pyrazol-5-yl)-1H-indole-4-carboxamide
InChI:
InChI=1S/C15H16N4O/c1-9(2)17-15(20)10-4-3-5-12-11(10)8-14(18-12)13-6-7-16-19-13/h3-9,18H,1-2H3,(H,16,19)(H,17,20)
InChI Key:
NMHANYXIAVMUSE-UHFFFAOYSA-N
SMILES:
CC(NC(=O)c1cccc2c1cc([nH]2)c1n[nH]cc1)C
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.132g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
268.32g/mol
Monoisotopic Mass:
268.132g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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