1-(benzenesulfonyl)-3-(2,5-dichloropyrimidin-4-yl)indole


Chemical Name: 1-(benzenesulfonyl)-3-(2,5-dichloropyrimidin-4-yl)indole
CAS Number: 882562-40-5
Product Number: AG004CGG(AGN-PC-0J0Y3I)
Synonyms:
MDL No:
Molecular Formula: C18H11Cl2N3O2S
Molecular Weight: 404.2698

Identification/Properties


Properties
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
404.265g/mol
XLogP3:
4.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
402.995g/mol
Monoisotopic Mass:
402.995g/mol
Topological Polar Surface Area:
73.2A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
594
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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