Home Carbonyls 4-fluoro-3-(1H-indole-3-carbonyl)aniline

4-fluoro-3-(1H-indole-3-carbonyl)aniline

CAS No.:
1498182-63-0
Catalog Number:
AG01BBXG
Molecular Formula:
C15H11FN2O
Molecular Weight:
254.2590
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Product Description
Catalog Number:
AG01BBXG
Chemical Name:
4-fluoro-3-(1H-indole-3-carbonyl)aniline
CAS Number:
1498182-63-0
Molecular Formula:
C15H11FN2O
Molecular Weight:
254.2590
MDL Number:
MFCD20170543
IUPAC Name:
(5-amino-2-fluorophenyl)-(1H-indol-3-yl)methanone
InChI:
InChI=1S/C15H11FN2O/c16-13-6-5-9(17)7-11(13)15(19)12-8-18-14-4-2-1-3-10(12)14/h1-8,18H,17H2
InChI Key:
JDBWUUOGIZODHN-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C(=O)c1c[nH]c2c1cccc2)F
Properties
Complexity:
349  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.086g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
254.264g/mol
Monoisotopic Mass:
254.086g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties