Chemical ID: 7375851

Cc1c(nc(s1)NC(=O)COc2ccccc2Cl)c3ccc(cc3)OC
Chemical ID:
7375851
Name [?]:
2-(2-chlorophenoxy)-N-[4-(4-methoxyphenyl)-5-methyl-thiazol-2-yl]-acetamide
SMILES [?]:
Cc1c(nc(s1)NC(=O)COc2ccccc2Cl)c3ccc(cc3)OC
InChi [?]:
InChI=1/C19H17ClN2O3S/c1-12-18(13-7-9-14(24-2)10-8-13)22-19(26-12)21-17(23)11-25-16-6-4-3-5-15(16)20/h3-10H,11H2,1-2H3,(H,21,22,23)
InChi Info:
AuxInfo=1/1/N:1,26,15,14,16,13,20,24,21,23,10,2,19,22,17,12,8,3,5,18,7,4,9,25,11,6/E:(7,8)(9,10)/rA:26nCCCNCSNCOCOCCCCCCClCCCCCCOC/rB:s1;d2;s3;d4;s2s5;s5;s7;d8;s8;s10;s11;s12;d13;s14;d15;d12s16;s17;s3;s19;d20;s21;d22;d19s23;s22;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17ClN2O3S
All Atoms:43
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:9.10653
Area:607.36
Solvation:-6.07748
Coulombic:-41.9765
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:3.9
LogP (Chemaxon):4.48

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