Chemical ID: 4413865

c1ccc(cc1)C=CC(=O)NC(=S)Nc2ccc(c(c2)C(=O)O)Cl
Chemical ID:
4413865
Name [?]:
2-chloro-5-(3-phenylprop-2-enoylthiocarbamoylamino)benzoic acid
SMILES [?]:
c1ccc(cc1)C=CC(=O)NC(=S)Nc2ccc(c(c2)C(=O)O)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H13ClN2O3S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.63957
Area:537.278
Solvation:-3.79237
Coulombic:-60.8551
Bond Count [?]
All:25
Single:15
Double:10
Rotors:7
Chiral:1
Rigid Segments:6
Chemical Properties
Molecular Weight:360.815
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:3.95
LogP (Chemaxon):4.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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