Chemical ID: 4328659

Cc1cccc(c1)NC(=O)C(=Cc2ccc(o2)c3ccccc3[N+](=O)[O-])C#N
Chemical ID:
4328659
Name [?]:
2-cyano-N-(m-tolyl)-3-[5-(2-nitrophenyl)-2-furyl]-prop-2-enamide
SMILES [?]:
Cc1cccc(c1)NC(=O)C(=Cc2ccc(o2)c3ccccc3[N+](=O)[O-])C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H15N3O4
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:3.96959
Area:542.257
Solvation:-9.58683
Coulombic:-39.8248
Bond Count [?]
All:30
Single:18
Double:11
Rotors:6
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:373.362
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.77
LogP (Chemaxon):4.36

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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