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Home > Indoles and Oxindole > 827317-09-9
827317-09-9 | 1H-Indole-5-carboxamide, N-(4-methoxyphenyl)-2-(1H-pyrazol-3-yl)-
CAS No: 827317-09-9 Catalog No: AG00501H MDL No:
Product Description
Catalog Number:
AG00501H
Chemical Name:
1H-Indole-5-carboxamide, N-(4-methoxyphenyl)-2-(1H-pyrazol-3-yl)-
CAS Number:
827317-09-9
Molecular Formula:
C19H16N4O2
Molecular Weight:
332.3559
IUPAC Name:
N-(4-methoxyphenyl)-2-(1H-pyrazol-5-yl)-1H-indole-5-carboxamide
InChI:
InChI=1S/C19H16N4O2/c1-25-15-5-3-14(4-6-15)21-19(24)12-2-7-16-13(10-12)11-18(22-16)17-8-9-20-23-17/h2-11,22H,1H3,(H,20,23)(H,21,24)
InChI Key:
QCOWOHIHCKVORN-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=O)c1ccc2c(c1)cc([nH]2)c1n[nH]cc1
Properties
Complexity:
466
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.127g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
332.363g/mol
Monoisotopic Mass:
332.127g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
82.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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