Chemical ID: 6218188

c1ccc(cc1)OCC(=O)Nc2ncc(s2)Cc3ccccc3Cl
Chemical ID:
6218188
Name [?]:
N-[5-[(2-chlorophenyl)methyl]thiazol-2-yl]-2-phenoxy-acetamide
SMILES [?]:
c1ccc(cc1)OCC(=O)Nc2ncc(s2)Cc3ccccc3Cl
InChi [?]:
InChI=1/C18H15ClN2O2S/c19-16-9-5-4-6-13(16)10-15-11-20-18(24-15)21-17(22)12-23-14-7-2-1-3-8-14/h1-9,11H,10,12H2,(H,20,21,22)
InChi Info:
AuxInfo=1/1/N:1,2,6,20,21,19,3,5,22,17,14,8,18,4,15,23,9,12,24,13,11,10,7,16/E:(2,3)(7,8)/rA:24nCCCCCCOCCONCNCCSCCCCCCCCl/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;d9;s9;s11;d12;s13;d14;s12s15;s15;s17;s18;d19;s20;d21;d18s22;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H15ClN2O2S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.9445
Area:566.683
Solvation:-5.22258
Coulombic:-34.6536
Bond Count [?]
All:26
Single:17
Double:9
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:358.843
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.25
LogP (Chemaxon):4.34

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