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144514-38-5

144514-38-5 | Ethanone, 1-[4-(5-amino-2-chlorophenyl)-1-piperazinyl]-

CAS No: 144514-38-5 Catalog No: AG001JOD MDL No:

Product Description

Catalog Number:
AG001JOD
Chemical Name:
Ethanone, 1-[4-(5-amino-2-chlorophenyl)-1-piperazinyl]-
CAS Number:
144514-38-5
Molecular Formula:
C12H16ClN3O
Molecular Weight:
253.7279
IUPAC Name:
1-[4-(5-amino-2-chlorophenyl)piperazin-1-yl]ethanone
InChI:
InChI=1S/C12H16ClN3O/c1-9(17)15-4-6-16(7-5-15)12-8-10(14)2-3-11(12)13/h2-3,8H,4-7,14H2,1H3
InChI Key:
NAKMDRNNFRKBHS-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCN(CC1)c1cc(N)ccc1Cl

Properties

Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.098g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.73g/mol
Monoisotopic Mass:
253.098g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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