Chemical ID: 4434408

c1ccc(c(c1)CN2CCCC(C2)C(=O)N3CCCC3)Br
Chemical ID:
4434408
Name [?]:
[1-[(2-bromophenyl)methyl]-3-piperidyl]-pyrrolidin-1-yl-methanone
SMILES [?]:
c1ccc(c(c1)CN2CCCC(C2)C(=O)N3CCCC3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H23BrN2O
All Atoms:21
Heavy Atoms:21
Chiral Atoms:2
ZAP Information [?]
Total:9.80871
Area:498.382
Solvation:-2.65085
Coulombic:-21.9147
Bond Count [?]
All:23
Single:19
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:351.281
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.93
LogP (Chemaxon):2.88

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