Chemical ID: 7428327

Cc1c(nc(s1)NC(=O)CCl)c2ccc(cc2)Cl
Chemical ID:
7428327
Name [?]:
2-chloro-N-[4-(4-chlorophenyl)-5-methyl-thiazol-2-yl]-acetamide
SMILES [?]:
Cc1c(nc(s1)NC(=O)CCl)c2ccc(cc2)Cl
InChi [?]:
InChI=1/C12H10Cl2N2OS/c1-7-11(8-2-4-9(14)5-3-8)16-12(18-7)15-10(17)6-13/h2-5H,6H2,1H3,(H,15,16,17)
InChi Info:
AuxInfo=1/1/N:1,13,17,14,16,10,2,12,15,8,3,5,11,18,7,4,9,6/E:(2,3)(4,5)/rA:18nCCCNCSNCOCClCCCCCCCl/rB:s1;d2;s3;d4;s2s5;s5;s7;d8;s8;s10;s3;s12;d13;s14;d15;d12s16;s15;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H10Cl2N2OS
All Atoms:28
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:9.10997
Area:481.72
Solvation:-2.93302
Coulombic:-26.8982
Bond Count [?]
All:19
Single:13
Double:6
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:301.192
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.82
LogP (Chemaxon):3.82

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