Chemical ID: 7143084

CC(=O)Nc1ccc(cc1)NC2=NC(=O)C(=Cc3ccc(o3)c4ccc(c(c4)Cl)Cl)S2
Chemical ID:
7143084
Name [?]:
N-[4-[5-[[5-(3,4-dichlorophenyl)-2-furyl]methylene]-4-oxo-thiazol-2-yl]aminophenyl]acetamide
SMILES [?]:
CC(=O)Nc1ccc(cc1)NC2=NC(=O)C(=Cc3ccc(o3)c4ccc(c(c4)Cl)Cl)S2
InChi [?]:
InChI=1/C22H15Cl2N3O3S/c1-12(28)25-14-3-5-15(6-4-14)26-22-27-21(29)20(31-22)11-16-7-9-19(30-16)13-2-8-17(23)18(24)10-13/h2-11H,1H3,(H,25,28)(H,26,27,29)
InChi Info:
AuxInfo=1/1/N:1,24,6,10,7,9,19,25,20,28,17,2,23,5,8,18,26,27,21,16,14,12,30,29,4,11,13,3,15,22,31/E:(3,4)(5,6)/rA:31nCCONCCCCCCNCNCOCCCCCCOCCCCCCClClS/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s8;s11;d12;s13;d14;s14;w16;s17;d18;s19;d20;s18s21;s21;s23;d24;s25;d26;d23s27;s27;s26;s12s16;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H15Cl2N3O3S
All Atoms:46
Heavy Atoms:31
Chiral Atoms:None
ZAP Information [?]
Total:12.3559
Area:681.86
Solvation:-4.69063
Coulombic:-54.4081
Bond Count [?]
All:34
Single:22
Double:12
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.08
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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