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Home > Fluorides > 862785-72-6
862785-72-6 | 2-(3-Formyl-indol-1-yl)-N-(3-trifluoromethyl-phenyl)-acetamide
CAS No: 862785-72-6 Catalog No: AG01EXW3 MDL No:
Product Description
Catalog Number:
AG01EXW3
Chemical Name:
2-(3-Formyl-indol-1-yl)-N-(3-trifluoromethyl-phenyl)-acetamide
CAS Number:
862785-72-6
Molecular Formula:
C18H13F3N2O2
Molecular Weight:
346.3032
IUPAC Name:
2-(3-formylindol-1-yl)-N-[3-(trifluoromethyl)phenyl]acetamide
InChI:
InChI=1S/C18H13F3N2O2/c19-18(20,21)13-4-3-5-14(8-13)22-17(25)10-23-9-12(11-24)15-6-1-2-7-16(15)23/h1-9,11H,10H2,(H,22,25)
InChI Key:
YDMDSWNYGYSMOD-UHFFFAOYSA-N
SMILES:
O=Cc1cn(c2c1cccc2)CC(=O)Nc1cccc(c1)C(F)(F)F
Properties
Complexity:
497
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.093g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
346.309g/mol
Monoisotopic Mass:
346.093g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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