Chemical ID: 7521473

Cc1cccc(c1)Cc2cnc(s2)NC(=O)COc3ccc(cc3C)C
Chemical ID:
7521473
Name [?]:
2-(2,4-dimethylphenoxy)-N-[5-(m-tolylmethyl)thiazol-2-yl]-acetamide
SMILES [?]:
Cc1cccc(c1)Cc2cnc(s2)NC(=O)COc3ccc(cc3C)C
InChi [?]:
InChI=1/C21H22N2O2S/c1-14-5-4-6-17(10-14)11-18-12-22-21(26-18)23-20(24)13-25-19-8-7-15(2)9-16(19)3/h4-10,12H,11,13H2,1-3H3,(H,22,23,24)
InChi Info:
AuxInfo=1/1/N:1,26,25,4,3,5,21,20,23,7,8,10,17,2,22,24,6,9,19,15,12,11,14,16,18,13/rA:26nCCCCCCCCCCNCSNCOCOCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s10;d11;s9s12;s12;s14;d15;s15;s17;s18;s19;d20;s21;d22;d19s23;s24;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C21H22N2O2S
All Atoms:48
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:10.0689
Area:609.511
Solvation:-5.16892
Coulombic:-33.8627
Bond Count [?]
All:28
Single:19
Double:9
Rotors:7
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.73
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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