Chemical ID: 7028857

c1ccc(c(c1)NC(=O)c2ccc(o2)c3ccc(c(c3)Cl)Cl)I
Chemical ID:
7028857
Name [?]:
5-(3,4-dichlorophenyl)-N-(2-iodophenyl)-furan-2-carboxamide
SMILES [?]:
c1ccc(c(c1)NC(=O)c2ccc(o2)c3ccc(c(c3)Cl)Cl)I
InChi [?]:
InChI=1/C17H10Cl2INO2/c18-11-6-5-10(9-12(11)19)15-7-8-16(23-15)17(22)21-14-4-2-1-3-13(14)20/h1-9H,(H,21,22)
InChi Info:
AuxInfo=1/1/N:2,1,3,6,16,17,12,11,20,15,18,19,4,5,13,10,8,22,21,23,7,9,14/rA:23nCCCCCCNCOCCCCOCCCCCCClClI/rB:s1;d2;s3;d4;d1s5;s5;s7;d8;s8;d10;s11;d12;s10s13;s13;s15;d16;s17;d18;d15s19;s19;s18;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H10Cl2INO2
All Atoms:33
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:12.2333
Area:570.155
Solvation:-2.02054
Coulombic:-33.5206
Bond Count [?]
All:25
Single:16
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:458.077
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.96
LogP (Chemaxon):4.88

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