Chemical ID: 4724829

c1ccc(c(c1)C=C2C(=O)NC(=O)S2)O
Chemical ID:
4724829
Name [?]:
5-[(2-hydroxyphenyl)methylene]thiazolidine-2,4-dione
SMILES [?]:
c1ccc(c(c1)C=C2C(=O)NC(=O)S2)O
InChi [?]:
InChI=1/C10H7NO3S/c12-7-4-2-1-3-6(7)5-8-9(13)11-10(14)15-8/h1-5,12H,(H,11,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,7,5,4,8,9,12,11,15,10,13,14/rA:15nCCCCCCCCCONCOSO/rB:s1;d2;s3;d4;d1s5;s5;w7;s8;d9;s9;s11;d12;s8s12;s4;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H7NO3S
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:6.35597
Area:371.582
Solvation:-2.93357
Coulombic:-47.9416
Bond Count [?]
All:16
Single:10
Double:6
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:221.234
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.03
LogP (Chemaxon):1.54

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Descriptor Annotations

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