Chemical ID: 3991158

CC1(c2ccccc2N(C1=CC(=O)CC#N)C)C
Chemical ID:
3991158
Name [?]:
3-oxo-4-(1,3,3-trimethylindolin-2-ylidene)-butanenitrile
SMILES [?]:
CC1(c2ccccc2N(C1=CC(=O)CC#N)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H16N2O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.07369
Area:423.56
Solvation:-3.51532
Coulombic:-15.056
Bond Count [?]
All:19
Single:13
Double:5
Rotors:2
Chiral:1
Rigid Segments:3
Chemical Properties
Molecular Weight:240.3
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.96
LogP (Chemaxon):3.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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