Chemical ID: 5902295

CCC(CC)C(=O)N1CCN(CC1)c2ccc(cc2)NC(=O)Nc3ccc(cc3)C
Chemical ID:
5902295
Name [?]:
1-[4-[4-(2-ethylbutanoyl)piperazin-1-yl]phenyl]-3-(p-tolyl)urea
SMILES [?]:
CCC(CC)C(=O)N1CCN(CC1)c2ccc(cc2)NC(=O)Nc3ccc(cc3)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H32N4O2
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:12.8521
Area:665.12
Solvation:-3.7759
Coulombic:-57.411
Bond Count [?]
All:32
Single:24
Double:8
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:408.537
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.24
LogP (Chemaxon):5.33

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