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150355-01-4 | Benzamide, 5-bromo-2-[[(4-chlorophenyl)sulfonyl]amino]-N-(5,7-dibromo-2,1,3-benzothiadiazol-4-yl)-
CAS No: 150355-01-4 Catalog No: AG001MJ6 MDL No:
Product Description
Catalog Number:
AG001MJ6
Chemical Name:
Benzamide, 5-bromo-2-[[(4-chlorophenyl)sulfonyl]amino]-N-(5,7-dibromo-2,1,3-benzothiadiazol-4-yl)-
CAS Number:
150355-01-4
Molecular Formula:
C19H10Br3ClN4O3S2
Molecular Weight:
681.6027
IUPAC Name:
5-bromo-2-[(4-chlorophenyl)sulfonylamino]-N-(5,7-dibromo-2,1,3-benzothiadiazol-4-yl)benzamide
InChI:
InChI=1S/C19H10Br3ClN4O3S2/c20-9-1-6-15(27-32(29,30)11-4-2-10(23)3-5-11)12(7-9)19(28)24-16-13(21)8-14(22)17-18(16)26-31-25-17/h1-8,27H,(H,24,28)
InChI Key:
DXKDLAPUQGRJTF-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)C(=O)Nc1c(Br)cc(c2c1nsn2)Br)NS(=O)(=O)c1ccc(cc1)Cl
Properties
Complexity:
784
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
679.741g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
681.596g/mol
Monoisotopic Mass:
677.743g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.4
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