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Home > Indoles and Oxindole > 827317-58-8
827317-58-8 | 1H-Indole-6-carboxamide, N-propyl-2-(1H-pyrazol-3-yl)-
CAS No: 827317-58-8 Catalog No: AG004V4O MDL No:
Product Description
Catalog Number:
AG004V4O
Chemical Name:
1H-Indole-6-carboxamide, N-propyl-2-(1H-pyrazol-3-yl)-
CAS Number:
827317-58-8
Molecular Formula:
C15H16N4O
Molecular Weight:
268.3137
IUPAC Name:
N-propyl-2-(1H-pyrazol-5-yl)-1H-indole-6-carboxamide
InChI:
InChI=1S/C15H16N4O/c1-2-6-16-15(20)11-4-3-10-8-14(18-13(10)9-11)12-5-7-17-19-12/h3-5,7-9,18H,2,6H2,1H3,(H,16,20)(H,17,19)
InChI Key:
MUXKDEHSJFHVTA-UHFFFAOYSA-N
SMILES:
CCCNC(=O)c1ccc2c(c1)[nH]c(c2)c1n[nH]cc1
Properties
Complexity:
349
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:
4
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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