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190437-89-9 | Benzamide, N-2-benzothiazolyl-3,4-dichloro-
CAS No: 190437-89-9 Catalog No: AG002EK3 MDL No:
Product Description
Catalog Number:
AG002EK3
Chemical Name:
Benzamide, N-2-benzothiazolyl-3,4-dichloro-
CAS Number:
190437-89-9
Molecular Formula:
C14H8Cl2N2OS
Molecular Weight:
323.1971
IUPAC Name:
N-(1,3-benzothiazol-2-yl)-3,4-dichlorobenzamide
InChI:
InChI=1S/C14H8Cl2N2OS/c15-9-6-5-8(7-10(9)16)13(19)18-14-17-11-3-1-2-4-12(11)20-14/h1-7H,(H,17,18,19)
InChI Key:
RXESHZAWKAARKI-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)Cl)Cl)Nc1nc2c(s1)cccc2
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
321.973g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
323.191g/mol
Monoisotopic Mass:
321.973g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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