Chemical ID: 4156461

Cc1cc(c(c(c1)Cl)NC(=O)NC(C)(C)c2cccc(c2)C(=C)C)C
Chemical ID:
4156461
Name [?]:
1-(2-chloro-4,6-dimethyl-phenyl)-3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-urea
SMILES [?]:
Cc1cc(c(c(c1)Cl)NC(=O)NC(C)(C)c2cccc(c2)C(=C)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H25ClN2O
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:12.4479
Area:575.505
Solvation:-1.93977
Coulombic:-38.3148
Bond Count [?]
All:26
Single:18
Double:8
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:356.889
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:5.84
LogP (Chemaxon):4.57

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