Chemical ID: 5541109

Cc1ccc(cc1)N=C2N(C(=O)C(=Cc3cccc(c3)OC)S2)C
Chemical ID:
5541109
Name [?]:
5-[(3-methoxyphenyl)methylene]-3-methyl-2-(p-tolylimino)thiazolidin-4-one
SMILES [?]:
Cc1ccc(cc1)N=C2N(C(=O)C(=Cc3cccc(c3)OC)S2)C
InChi [?]:
InChI=1/C19H18N2O2S/c1-13-7-9-15(10-8-13)20-19-21(2)18(22)17(24-19)12-14-5-4-6-16(11-14)23-3/h4-12H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,24,22,17,16,18,3,7,4,6,20,14,2,15,5,19,13,11,9,8,10,12,21,23/E:(7,8)(9,10)/rA:24nCCCCCCCNCNCOCCCCCCCCOCSC/rB:s1;s2;d3;s4;d5;d2s6;s5;w8;s9;s10;d11;s11;w13;s14;s15;d16;s17;d18;d15s19;s19;s21;s9s13;s10;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H18N2O2S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.0929
Area:527.408
Solvation:-3.09227
Coulombic:-32.893
Bond Count [?]
All:26
Single:17
Double:9
Rotors:3
Chiral:2
Rigid Segments:4
Chemical Properties
Molecular Weight:338.424
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:3.59
LogP (Chemaxon):4.81

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