Chemical ID: 4561725

CCC(C)C1C(=O)NC(=Cc2ccccc2Cl)C(=O)N1
Chemical ID:
4561725
Name [?]:
3-[(2-chlorophenyl)methylene]-6-sec-butyl-piperazine-2,5-dione
SMILES [?]:
CCC(C)C1C(=O)NC(=Cc2ccccc2Cl)C(=O)N1
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H17ClN2O2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:2
ZAP Information [?]
Total:9.81847
Area:478.549
Solvation:-2.14526
Coulombic:-45.8922
Bond Count [?]
All:21
Single:15
Double:6
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:292.76
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.11
LogP (Chemaxon):2.35

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue