Chemical ID: 6219646

CCc1ccc(cc1)c2csc(n2)NC(=O)COc3ccc(cc3Cl)Cl
Chemical ID:
6219646
Name [?]:
2-(2,4-dichlorophenoxy)-N-[4-(4-ethylphenyl)thiazol-2-yl]-acetamide
SMILES [?]:
CCc1ccc(cc1)c2csc(n2)NC(=O)COc3ccc(cc3Cl)Cl
InChi [?]:
InChI=1/C19H16Cl2N2O2S/c1-2-12-3-5-13(6-4-12)16-11-26-19(22-16)23-18(24)10-25-17-8-7-14(20)9-15(17)21/h3-9,11H,2,10H2,1H3,(H,22,23,24)
InChi Info:
AuxInfo=1/1/N:1,2,4,8,5,7,21,20,23,17,10,3,6,22,24,9,19,15,12,26,25,13,14,16,18,11/E:(3,4)(5,6)/rA:26nCCCCCCCCCCSCNNCOCOCCCCCCClCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s10;s11;s9d12;s12;s14;d15;s15;s17;s18;s19;d20;s21;d22;d19s23;s24;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16Cl2N2O2S
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.8416
Area:629.607
Solvation:-4.89855
Coulombic:-35.3543
Bond Count [?]
All:28
Single:19
Double:9
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:407.314
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.66
LogP (Chemaxon):6.12

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Descriptor Annotations

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