Chemical ID: 6464611

c1cc(cc(c1)[N+](=O)[O-])NC(=O)C(=Cc2ccc(o2)c3ccc(cc3)S(=O)(=O)N)C#N
Chemical ID:
6464611
Name [?]:
2-cyano-N-(3-nitrophenyl)-3-[5-(4-sulfamoylphenyl)-2-furyl]-prop-2-enamide
SMILES [?]:
c1cc(cc(c1)[N+](=O)[O-])NC(=O)C(=Cc2ccc(o2)c3ccc(cc3)S(=O)(=O)N)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H14N4O6S
All Atoms:31
Heavy Atoms:31
Chiral Atoms:0
ZAP Information [?]
Total:6.10677
Area:653.395
Solvation:-10.2281
Coulombic:-57.9526
Bond Count [?]
All:33
Single:19
Double:13
Rotors:7
Chiral:1
Rigid Segments:7
Chemical Properties
Molecular Weight:438.415
H-Bond Donors:3
H-Bond Acceptors:9
XLogP:2.8
LogP (Chemaxon):2.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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