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951460-64-3 | N-(4-chlorophenyl)-2-(1,1-dioxo-2H-1lambda6,2,4-benzothiadiazin-3-yl)acetamide
CAS No: 951460-64-3 Catalog No: AG01FI9D MDL No:
Product Description
Catalog Number:
AG01FI9D
Chemical Name:
N-(4-chlorophenyl)-2-(1,1-dioxo-2H-1lambda6,2,4-benzothiadiazin-3-yl)acetamide
CAS Number:
951460-64-3
Molecular Formula:
C15H12ClN3O3S
Molecular Weight:
349.7921
IUPAC Name:
N-(4-chlorophenyl)-2-(1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-3-yl)acetamide
InChI:
InChI=1S/C15H12ClN3O3S/c16-10-5-7-11(8-6-10)17-15(20)9-14-18-12-3-1-2-4-13(12)23(21,22)19-14/h1-8H,9H2,(H,17,20)(H,18,19)
InChI Key:
XVDFSJYDLIIBSR-UHFFFAOYSA-N
SMILES:
O=C(CC1=Nc2ccccc2S(=O)(=O)N1)Nc1ccc(cc1)Cl
Properties
Complexity:
579
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.029g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
349.789g/mol
Monoisotopic Mass:
349.029g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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