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827590-55-6 | Benzamide, N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-4-chloro-
CAS No: 827590-55-6 Catalog No: AG004Z0N MDL No:
Product Description
Catalog Number:
AG004Z0N
Chemical Name:
Benzamide, N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-4-chloro-
CAS Number:
827590-55-6
Molecular Formula:
C19H16BrClN2O
Molecular Weight:
403.7001
IUPAC Name:
N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-4-chlorobenzamide
InChI:
InChI=1S/C19H16BrClN2O/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:
MJVBNTSTNSJMIC-UHFFFAOYSA-N
SMILES:
Clc1ccc(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:
402.013g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
403.704g/mol
Monoisotopic Mass:
402.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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