Chemical ID: 4525374

CCC(=O)OC(C1CC(N(N1C(=O)C)c2ccccc2)C)C(=O)C
Chemical ID:
4525374
Name [?]:
[1-(2-acetyl-5-methyl-1-phenyl-pyrazolidin-3-yl)-2-oxo-propyl] propanoate
SMILES [?]:
CCC(=O)OC(C1CC(N(N1C(=O)C)c2ccccc2)C)C(=O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H24N2O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:4
ZAP Information [?]
Total:7.65647
Area:518.951
Solvation:-5.3173
Coulombic:-39.2902
Bond Count [?]
All:25
Single:19
Double:6
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:332.394
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:1.63
LogP (Chemaxon):2.17

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