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496960-30-6 | 2-(3-formyl-1H-indol-1-yl)-N-(4-methoxyphenyl)acetamide
CAS No: 496960-30-6 Catalog No: AG018VRB MDL No:
Product Description
Catalog Number:
AG018VRB
Chemical Name:
2-(3-formyl-1H-indol-1-yl)-N-(4-methoxyphenyl)acetamide
CAS Number:
496960-30-6
Molecular Formula:
C18H16N2O3
Molecular Weight:
308.3312
IUPAC Name:
2-(3-formylindol-1-yl)-N-(4-methoxyphenyl)acetamide
InChI:
InChI=1S/C18H16N2O3/c1-23-15-8-6-14(7-9-15)19-18(22)11-20-10-13(12-21)16-4-2-3-5-17(16)20/h2-10,12H,11H2,1H3,(H,19,22)
InChI Key:
SOPMARNJOBHEPT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=O)Cn1cc(c2c1cccc2)C=O
Properties
Complexity:
421
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.116g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.337g/mol
Monoisotopic Mass:
308.116g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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