Chemical ID: 4218119

CC1(C(CCC1(C)C(=O)O)C(=O)Nc2ccc(c(c2)Cl)Cl)C
Chemical ID:
4218119
Name [?]:
3-[(3,4-dichlorophenyl)carbamoyl]-1,2,2-trimethyl-cyclopentane-1-carboxylic acid
SMILES [?]:
CC1(C(CCC1(C)C(=O)O)C(=O)Nc2ccc(c(c2)Cl)Cl)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H19Cl2NO3
All Atoms:22
Heavy Atoms:22
Chiral Atoms:2
ZAP Information [?]
Total:9.88191
Area:510.804
Solvation:-2.88819
Coulombic:-48.124
Bond Count [?]
All:23
Single:18
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:344.232
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.81
LogP (Chemaxon):4.65

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