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182128-53-6 | 7-chloro-N-(4-chlorophenyl)-3,4-dihydro-2H-1,4-benzothiazine-4-carboxamide
CAS No: 182128-53-6 Catalog No: AG00IQ04 MDL No:MFCD00138833
Product Description
Catalog Number:
AG00IQ04
Chemical Name:
7-chloro-N-(4-chlorophenyl)-3,4-dihydro-2H-1,4-benzothiazine-4-carboxamide
CAS Number:
182128-53-6
Molecular Formula:
C15H12Cl2N2OS
Molecular Weight:
339.2396
MDL Number:
MFCD00138833
IUPAC Name:
7-chloro-N-(4-chlorophenyl)-2,3-dihydro-1,4-benzothiazine-4-carboxamide
InChI:
InChI=1S/C15H12Cl2N2OS/c16-10-1-4-12(5-2-10)18-15(20)19-7-8-21-14-9-11(17)3-6-13(14)19/h1-6,9H,7-8H2,(H,18,20)
InChI Key:
UVVGXPFNNMDNSR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)NC(=O)N1CCSc2c1ccc(c2)Cl
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.005g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
339.234g/mol
Monoisotopic Mass:
338.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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