Chemical ID: 4458842

CC(C12CC3CC(C1)CC(C3)C2)NC(=O)c4cc(ccc4Cl)Br
Chemical ID:
4458842
Name [?]:
N-[1-(1-adamantyl)ethyl]-5-bromo-2-chloro-benzamide
SMILES [?]:
CC(C12CC3CC(C1)CC(C3)C2)NC(=O)c4cc(ccc4Cl)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H23BrClNO
All Atoms:23
Heavy Atoms:23
Chiral Atoms:1
ZAP Information [?]
Total:11.2383
Area:515.668
Solvation:-1.65336
Coulombic:-23.9283
Bond Count [?]
All:26
Single:22
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:396.749
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:6.99
LogP (Chemaxon):5.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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