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197166-38-4

197166-38-4 | Piperazine, 1-(3-chlorophenyl)-4-[(2,5-dichlorophenyl)sulfonyl]-

CAS No: 197166-38-4 Catalog No: AG002AMT MDL No:

Product Description

Catalog Number:
AG002AMT
Chemical Name:
Piperazine, 1-(3-chlorophenyl)-4-[(2,5-dichlorophenyl)sulfonyl]-
CAS Number:
197166-38-4
Molecular Formula:
C16H15Cl3N2O2S
Molecular Weight:
405.7265
IUPAC Name:
1-(3-chlorophenyl)-4-(2,5-dichlorophenyl)sulfonylpiperazine
InChI:
InChI=1S/C16H15Cl3N2O2S/c17-12-2-1-3-14(10-12)20-6-8-21(9-7-20)24(22,23)16-11-13(18)4-5-15(16)19/h1-5,10-11H,6-9H2
InChI Key:
CMOHIYAYQCFWEZ-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)N1CCN(CC1)S(=O)(=O)c1cc(Cl)ccc1Cl
NSC Number:
678254

Properties

Complexity:
520  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
403.992g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
405.718g/mol
Monoisotopic Mass:
403.992g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  

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