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145040-29-5 | 1H-Indole-3-acetamide, 5-chloro-2-(4-chlorophenyl)-N,N-dihexyl-
CAS No: 145040-29-5 Catalog No: AG001KHX MDL No:
Product Description
Catalog Number:
AG001KHX
Chemical Name:
1H-Indole-3-acetamide, 5-chloro-2-(4-chlorophenyl)-N,N-dihexyl-
CAS Number:
145040-29-5
Molecular Formula:
C28H36Cl2N2O
Molecular Weight:
487.5042
IUPAC Name:
2-[5-chloro-2-(4-chlorophenyl)-1H-indol-3-yl]-N,N-dihexylacetamide
InChI:
InChI=1S/C28H36Cl2N2O/c1-3-5-7-9-17-32(18-10-8-6-4-2)27(33)20-25-24-19-23(30)15-16-26(24)31-28(25)21-11-13-22(29)14-12-21/h11-16,19,31H,3-10,17-18,20H2,1-2H3
InChI Key:
XTZUPNNVXIMWAR-UHFFFAOYSA-N
SMILES:
CCCCCCN(C(=O)Cc1c([nH]c2c1cc(Cl)cc2)c1ccc(cc1)Cl)CCCCCC
Properties
Complexity:
554
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
486.22g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
487.509g/mol
Monoisotopic Mass:
486.22g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
36.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9
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