Chemical ID: 5801328

Cc1cccc(c1)N=C2NC(=O)C(=Cc3ccc(cc3)N(C)C)S2
Chemical ID:
5801328
Name [?]:
5-[(4-dimethylaminophenyl)methylene]-2-(m-tolylimino)thiazolidin-4-one
SMILES [?]:
Cc1cccc(c1)N=C2NC(=O)C(=Cc3ccc(cc3)N(C)C)S2
InChi [?]:
InChI=1/C19H19N3OS/c1-13-5-4-6-15(11-13)20-19-21-18(23)17(24-19)12-14-7-9-16(10-8-14)22(2)3/h4-12H,1-3H3,(H,20,21,23)
InChi Info:
AuxInfo=1/1/N:1,22,23,4,3,5,16,20,17,19,7,14,2,15,6,18,13,11,9,8,10,21,12,24/E:(2,3)(7,8)(9,10)/rA:24nCCCCCCCNCNCOCCCCCCCCNCCS/rB:s1;s2;d3;s4;d5;d2s6;s6;w8;s9;s10;d11;s11;w13;s14;s15;d16;s17;d18;d15s19;s18;s21;s21;s9s13;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H19N3OS
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:11.2939
Area:550.778
Solvation:-2.47555
Coulombic:-35.6007
Bond Count [?]
All:26
Single:17
Double:9
Rotors:3
Chiral:2
Rigid Segments:4
Chemical Properties
Molecular Weight:337.44
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:3.74
LogP (Chemaxon):5.08

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