Chemical ID: 6430362

Cc1cccc(c1)N=C2NC(=O)C(=Cc3cccc(c3)O)S2
Chemical ID:
6430362
Name [?]:
5-[(3-hydroxyphenyl)methylene]-2-(m-tolylimino)thiazolidin-4-one
SMILES [?]:
Cc1cccc(c1)N=C2NC(=O)C(=Cc3cccc(c3)O)S2
InChi [?]:
InChI=1/C17H14N2O2S/c1-11-4-2-6-13(8-11)18-17-19-16(21)15(22-17)10-12-5-3-7-14(20)9-12/h2-10,20H,1H3,(H,18,19,21)
InChi Info:
AuxInfo=1/1/N:1,4,17,3,16,5,18,7,20,14,2,15,6,19,13,11,9,8,10,21,12,22/rA:22nCCCCCCCNCNCOCCCCCCCCOS/rB:s1;s2;d3;s4;d5;d2s6;s6;w8;s9;s10;d11;s11;w13;s14;s15;d16;s17;d18;d15s19;s19;s9s13;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14N2O2S
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.87068
Area:505.096
Solvation:-2.75672
Coulombic:-45.4718
Bond Count [?]
All:24
Single:15
Double:9
Rotors:2
Chiral:2
Rigid Segments:3
Chemical Properties
Molecular Weight:310.371
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.12
LogP (Chemaxon):4.53

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