Chemical ID: 6991387

CC1=CCC(CC1=NNC(=O)COc2ccc(cc2Br)C(C)C)C(=C)C
Chemical ID:
6991387
Name [?]:
2-(2-bromo-4-isopropyl-phenoxy)-N-[(5-isopropenyl-2-methyl-1-cyclohex-2-enylidene)amino]acetamide
SMILES [?]:
CC1=CCC(CC1=NNC(=O)COc2ccc(cc2Br)C(C)C)C(=C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H27BrN2O2
All Atoms:53
Heavy Atoms:26
Chiral Atoms:1
ZAP Information [?]
Total:10.3655
Area:630.404
Solvation:-5.39456
Coulombic:-27.9048
Bond Count [?]
All:27
Single:20
Double:7
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:419.355
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:5.84
LogP (Chemaxon):5.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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