Chemical ID: 5892102

c1cc(c(cc1NC(=O)CCCCl)C(=O)NCC2CCCO2)N3CCCCC3
Chemical ID:
5892102
Name [?]:
5-(4-chlorobutanoylamino)-2-(1-piperidyl)-N-(tetrahydrofuran-2-ylmethyl)benzamide
SMILES [?]:
c1cc(c(cc1NC(=O)CCCCl)C(=O)NCC2CCCO2)N3CCCCC3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H30ClN3O3
All Atoms:28
Heavy Atoms:28
Chiral Atoms:1
ZAP Information [?]
Total:10.8632
Area:659.386
Solvation:-5.62146
Coulombic:-54.1187
Bond Count [?]
All:30
Single:25
Double:5
Rotors:10
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:407.934
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.06
LogP (Chemaxon):2.51

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