Chemical ID: 5382609

c1ccc(cc1)N(CCC#N)C(=O)CSc2cccc[n+]2[O-]
Chemical ID:
5382609
Name [?]:
N-(2-cyanoethyl)-2-[(1-oxido-2-pyridyl)sulfanyl]-N-phenyl-acetamide
SMILES [?]:
c1ccc(cc1)N(CCC#N)C(=O)CSc2cccc[n+]2[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H15N3O2S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:-1.13623
Area:534.79
Solvation:-14.506
Coulombic:-27.6584
Bond Count [?]
All:23
Single:15
Double:7
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:313.375
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.35
LogP (Chemaxon):0.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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