Chemical ID: 7519110

c1ccc(cc1)Cc2cnc(s2)NC(=O)COc3ccccc3C=O
Chemical ID:
7519110
Name [?]:
N-(5-benzylthiazol-2-yl)-2-(2-formylphenoxy)-acetamide
SMILES [?]:
c1ccc(cc1)Cc2cnc(s2)NC(=O)COc3ccccc3C=O
InChi [?]:
InChI=1/C19H16N2O3S/c22-12-15-8-4-5-9-17(15)24-13-18(23)21-19-20-11-16(25-19)10-14-6-2-1-3-7-14/h1-9,11-12H,10,13H2,(H,20,21,23)
InChi Info:
AuxInfo=1/1/N:1,2,6,21,20,3,5,22,19,7,9,24,16,4,23,8,18,14,11,10,13,25,15,17,12/E:(2,3)(6,7)/rA:25nCCCCCCCCCNCSNCOCOCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;d8;s9;d10;s8s11;s11;s13;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;s23;d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16N2O3S
All Atoms:41
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:8.69957
Area:582.666
Solvation:-5.86708
Coulombic:-41.5739
Bond Count [?]
All:27
Single:17
Double:10
Rotors:8
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:2.32
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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