Chemical ID: 6002274

CCCCCCN(CC(=O)Nc1ccon1)C(=O)c2cccc(c2)Br
Chemical ID:
6002274
Name [?]:
3-bromo-N-hexyl-N-(isoxazol-3-ylcarbamoylmethyl)benzamide
SMILES [?]:
CCCCCCN(CC(=O)Nc1ccon1)C(=O)c2cccc(c2)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H22BrN3O3
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.8592
Area:592.625
Solvation:-3.95642
Coulombic:-42.6672
Bond Count [?]
All:26
Single:19
Double:7
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:408.29
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.64
LogP (Chemaxon):4.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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