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827590-69-2 | Benzamide, N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-2-chloro-
CAS No: 827590-69-2 Catalog No: AG004Z0M MDL No:
Product Description
Catalog Number:
AG004Z0M
Chemical Name:
Benzamide, N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-2-chloro-
CAS Number:
827590-69-2
Molecular Formula:
C19H16BrClN2O
Molecular Weight:
403.7001
IUPAC Name:
N-(6-bromo-2,3,4,9-tetrahydro-1H-carbazol-1-yl)-2-chlorobenzamide
InChI:
InChI=1S/C19H16BrClN2O/c20-11-8-9-16-14(10-11)12-5-3-7-17(18(12)22-16)23-19(24)13-4-1-2-6-15(13)21/h1-2,4,6,8-10,17,22H,3,5,7H2,(H,23,24)
InChI Key:
LCDGHHJBAMVVCQ-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)c1CCCC(c1[nH]2)NC(=O)c1ccccc1Cl
Properties
Complexity:
476
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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