Chemical ID: 5354764

c1cc(cc(c1)Cl)N2CCN(CC2)C(=O)c3ccc(cc3)C#N
Chemical ID:
5354764
Name [?]:
4-[4-(3-chlorophenyl)piperazin-1-yl]carbonylbenzonitrile
SMILES [?]:
c1cc(cc(c1)Cl)N2CCN(CC2)C(=O)c3ccc(cc3)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H16ClN3O
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.4471
Area:533.882
Solvation:-2.89993
Coulombic:-28.6137
Bond Count [?]
All:25
Single:17
Double:7
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:325.792
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.72
LogP (Chemaxon):3.48

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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