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827318-24-1 | Propanamide, N-[2-(1H-pyrazol-4-yl)-1H-indol-5-yl]-
CAS No: 827318-24-1 Catalog No: AG008J6E MDL No:
Product Description
Catalog Number:
AG008J6E
Chemical Name:
Propanamide, N-[2-(1H-pyrazol-4-yl)-1H-indol-5-yl]-
CAS Number:
827318-24-1
Molecular Formula:
C14H14N4O
Molecular Weight:
254.2872
IUPAC Name:
N-[2-(1H-pyrazol-4-yl)-1H-indol-5-yl]propanamide
InChI:
InChI=1S/C14H14N4O/c1-2-14(19)17-11-3-4-12-9(5-11)6-13(18-12)10-7-15-16-8-10/h3-8,18H,2H2,1H3,(H,15,16)(H,17,19)
InChI Key:
FCXKDPZCFQLEJG-UHFFFAOYSA-N
SMILES:
CCC(=O)Nc1ccc2c(c1)cc([nH]2)c1c[nH]nc1
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.117g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
254.293g/mol
Monoisotopic Mass:
254.117g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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