Chemical ID: 5873151

COc1ccc(cc1)CN(CCc2ccc(c(c2)OC)OC)C(=O)Nc3cccc(c3)Cl
Chemical ID:
5873151
Name [?]:
3-(3-chlorophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(4-methoxyphenyl)methyl]urea
SMILES [?]:
COc1ccc(cc1)CN(CCc2ccc(c(c2)OC)OC)C(=O)Nc3cccc(c3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H27ClN2O4
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:10.5507
Area:714.273
Solvation:-7.30608
Coulombic:-53.3173
Bond Count [?]
All:34
Single:24
Double:10
Rotors:11
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:454.946
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.73
LogP (Chemaxon):5.16

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