Chemical ID: 6216233

Cc1cc(c(c(c1)C)c2csc(n2)NC(=O)c3cccc(c3)OC)C
Chemical ID:
6216233
Name [?]:
3-methoxy-N-[4-(2,4,6-trimethylphenyl)thiazol-2-yl]-benzamide
SMILES [?]:
Cc1cc(c(c(c1)C)c2csc(n2)NC(=O)c3cccc(c3)OC)C
InChi [?]:
InChI=1/C20H20N2O2S/c1-12-8-13(2)18(14(3)9-12)17-11-25-20(21-17)22-19(23)15-6-5-7-16(10-15)24-4/h5-11H,1-4H3,(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,8,25,24,19,18,20,7,3,22,10,2,6,4,17,21,9,5,15,12,13,14,16,23,11/E:(2,3)(8,9)(13,14)/rA:25nCCCCCCCCCCSCNNCOCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;d9;s10;s11;s9d12;s12;s14;d15;s15;s17;d18;s19;d20;d17s21;s21;s23;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C20H20N2O2S
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.5005
Area:565.185
Solvation:-3.62909
Coulombic:-35.5685
Bond Count [?]
All:27
Single:18
Double:9
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:352.451
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.05
LogP (Chemaxon):5.59

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