Chemical ID: 5538434

CC(C)C(C(=O)NN=Cc1ccccc1OCc2ccccc2C#N)NC(=O)c3ccc4c(c3)OCO4
Chemical ID:
5538434
Name [?]:
N-[1-[[2-[(2-cyanophenyl)methoxy]phenyl]methyleneaminocarbamoyl]-2-methyl-propyl]benzo[1,3]dioxole-5-carboxamide
SMILES [?]:
CC(C)C(C(=O)NN=Cc1ccccc1OCc2ccccc2C#N)NC(=O)c3ccc4c(c3)OCO4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C28H26N4O5
All Atoms:37
Heavy Atoms:37
Chiral Atoms:1
ZAP Information [?]
Total:12.9099
Area:771.285
Solvation:-6.37227
Coulombic:-70.3143
Bond Count [?]
All:40
Single:27
Double:12
Rotors:11
Chiral:1
Rigid Segments:9
Chemical Properties
Molecular Weight:498.53
H-Bond Donors:2
H-Bond Acceptors:9
XLogP:5.45
LogP (Chemaxon):4.6

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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