Home Halogens 4-(4-Benzyl-1-piperazinyl)-3-chlorophenylamine

4-(4-Benzyl-1-piperazinyl)-3-chlorophenylamine

CAS No.:
55403-32-2
Catalog Number:
AG00DOLX
Molecular Formula:
C17H20ClN3
Molecular Weight:
301.8138
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Product Description
Catalog Number:
AG00DOLX
Chemical Name:
4-(4-Benzyl-1-piperazinyl)-3-chlorophenylamine
CAS Number:
55403-32-2
Molecular Formula:
C17H20ClN3
Molecular Weight:
301.8138
MDL Number:
MFCD07365136
IUPAC Name:
4-(4-benzylpiperazin-1-yl)-3-chloroaniline
InChI:
InChI=1S/C17H20ClN3/c18-16-12-15(19)6-7-17(16)21-10-8-20(9-11-21)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13,19H2
InChI Key:
GASJCBVHHUXXCQ-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)Cl)N1CCN(CC1)Cc1ccccc1
Properties
Complexity:
311  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.135g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
301.818g/mol
Monoisotopic Mass:
301.135g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
32.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties