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827590-52-3

827590-52-3 | Benzamide, N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-4-fluoro-

CAS No: 827590-52-3 Catalog No: AG004UCX MDL No:

Product Description

Catalog Number:
AG004UCX
Chemical Name:
Benzamide, N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-4-fluoro-
CAS Number:
827590-52-3
Molecular Formula:
C19H16BrFN2O
Molecular Weight:
387.2455
IUPAC Name:
N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-4-fluorobenzamide
InChI:
InChI=1S/C19H16BrFN2O/c20-12-6-9-16-15(10-12)14-2-1-3-17(18(14)22-16)23-19(24)11-4-7-13(21)8-5-11/h4-10,17,22H,1-3H2,(H,23,24)
InChI Key:
NUMNOLWLEWXOHU-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C(=O)NC1CCCc2c1[nH]c1c2cc(cc1)Br

Properties

Complexity:
468  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
386.043g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
387.252g/mol
Monoisotopic Mass:
386.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

Literature

Title Journal
Tetrahydrocarbazole amides with potent activity against human papillomaviruses. Bioorganic & medicinal chemistry letters 20090801

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