Chemical ID: 7140008

Cc1ccc(cc1)C=C2C(=O)NC(=Nc3ccc(cc3)OC)S2
Chemical ID:
7140008
Name [?]:
2-(4-methoxyphenyl)imino-5-(p-tolylmethylene)thiazolidin-4-one
SMILES [?]:
Cc1ccc(cc1)C=C2C(=O)NC(=Nc3ccc(cc3)OC)S2
InChi [?]:
InChI=1/C18H16N2O2S/c1-12-3-5-13(6-4-12)11-16-17(21)20-18(23-16)19-14-7-9-15(22-2)10-8-14/h3-11H,1-2H3,(H,19,20,21)
InChi Info:
AuxInfo=1/1/N:1,22,3,7,4,6,16,20,17,19,8,2,5,15,18,9,10,13,14,12,11,21,23/E:(3,4)(5,6)(7,8)(9,10)/rA:23nCCCCCCCCCCONCNCCCCCCOCS/rB:s1;s2;d3;s4;d5;d2s6;s5;w8;s9;d10;s10;s12;w13;s14;s15;d16;s17;d18;d15s19;s18;s21;s9s13;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H16N2O2S
All Atoms:39
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.96728
Area:524.918
Solvation:-3.15567
Coulombic:-36.6842
Bond Count [?]
All:25
Single:16
Double:9
Rotors:3
Chiral:2
Rigid Segments:4
Chemical Properties
Molecular Weight:324.398
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.44
LogP (Chemaxon):4.57

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