Chemical ID: 4687712

CC1(CC(=CC(=O)C1)C=CNc2ccc(cc2Cl)Cl)C
Chemical ID:
4687712
Name [?]:
3-[2-(2,4-dichlorophenyl)aminovinyl]-5,5-dimethyl-cyclohex-2-en-1-one
SMILES [?]:
CC1(CC(=CC(=O)C1)C=CNc2ccc(cc2Cl)Cl)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H17Cl2NO
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:10.186
Area:494.58
Solvation:-2.17852
Coulombic:-21.0364
Bond Count [?]
All:21
Single:15
Double:6
Rotors:3
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:310.218
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.51
LogP (Chemaxon):4.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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