Chemical ID: 6218082

Cc1cc(ccc1OC)c2csc(n2)NC(=O)COc3ccc(cc3)Cl
Chemical ID:
6218082
Name [?]:
2-(4-chlorophenoxy)-N-[4-(4-methoxy-3-methyl-phenyl)thiazol-2-yl]-acetamide
SMILES [?]:
Cc1cc(ccc1OC)c2csc(n2)NC(=O)COc3ccc(cc3)Cl
InChi [?]:
InChI=1/C19H17ClN2O3S/c1-12-9-13(3-8-17(12)24-2)16-11-26-19(21-16)22-18(23)10-25-15-6-4-14(20)5-7-15/h3-9,11H,10H2,1-2H3,(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,9,5,22,24,21,25,6,3,18,11,2,4,23,20,10,7,16,13,26,14,15,17,8,19,12/E:(4,5)(6,7)/rA:26nCCCCCCCOCCCSCNNCOCOCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s4;d10;s11;s12;s10d13;s13;s15;d16;s16;s18;s19;s20;d21;s22;d23;d20s24;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17ClN2O3S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.32105
Area:610.768
Solvation:-5.94815
Coulombic:-41.3968
Bond Count [?]
All:28
Single:19
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:388.869
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:4.27
LogP (Chemaxon):4.95

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