Chemical ID: 7136213

Cc1ccc(cc1)C=C2C(=O)NC(=Nc3ccc(cc3)O)S2
Chemical ID:
7136213
Name [?]:
2-(4-hydroxyphenyl)imino-5-(p-tolylmethylene)thiazolidin-4-one
SMILES [?]:
Cc1ccc(cc1)C=C2C(=O)NC(=Nc3ccc(cc3)O)S2
InChi [?]:
InChI=1/C17H14N2O2S/c1-11-2-4-12(5-3-11)10-15-16(21)19-17(22-15)18-13-6-8-14(20)9-7-13/h2-10,20H,1H3,(H,18,19,21)
InChi Info:
AuxInfo=1/1/N:1,3,7,4,6,16,20,17,19,8,2,5,15,18,9,10,13,14,12,21,11,22/E:(2,3)(4,5)(6,7)(8,9)/rA:22nCCCCCCCCCCONCNCCCCCCOS/rB:s1;s2;d3;s4;d5;d2s6;s5;w8;s9;d10;s10;s12;w13;s14;s15;d16;s17;d18;d15s19;s18;s9s13;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14N2O2S
All Atoms:36
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:9.82997
Area:503.706
Solvation:-2.76267
Coulombic:-45.4057
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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