Chemical ID: 4238231

COc1ccc(cc1)CNC(=O)C2CCN(CC2)C(=O)c3ccc(cc3)Br
Chemical ID:
4238231
Name [?]:
1-(4-bromobenzoyl)-N-[(4-methoxyphenyl)methyl]piperidine-4-carboxamide
SMILES [?]:
COc1ccc(cc1)CNC(=O)C2CCN(CC2)C(=O)c3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H23BrN2O3
All Atoms:27
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.0412
Area:619.808
Solvation:-4.45402
Coulombic:-46.4102
Bond Count [?]
All:29
Single:21
Double:8
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:431.323
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.7
LogP (Chemaxon):2.94

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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