Chemical ID: 6283414

Cn1c2c(cccc2Cl)sc1=NC(=O)COc3ccc(cc3)Cl
Chemical ID:
6283414
Name [?]:
N-(4-chloro-3-methyl-benzothiazol-2-ylidene)-2-(4-chlorophenoxy)-acetamide
SMILES [?]:
Cn1c2c(cccc2Cl)sc1=NC(=O)COc3ccc(cc3)Cl
InChi [?]:
InChI=1/C16H12Cl2N2O2S/c1-20-15-12(18)3-2-4-13(15)23-16(20)19-14(21)9-22-11-7-5-10(17)6-8-11/h2-8H,9H2,1H3
InChi Info:
AuxInfo=1/0/N:1,6,7,5,19,21,18,22,15,20,17,8,4,13,3,11,23,9,12,2,14,16,10/E:(5,6)(7,8)/rA:23nCNCCCCCCClSCNCOCOCCCCCCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s4;s2s10;w11;s12;d13;s13;s15;s16;s17;d18;s19;d20;d17s21;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H12Cl2N2O2S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:10.0978
Area:543.134
Solvation:-3.48056
Coulombic:-32.5519
Bond Count [?]
All:25
Single:17
Double:8
Rotors:4
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:367.25
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.78
LogP (Chemaxon):5.43

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