Chemical ID: 7028793

c1ccc(c(c1)c2ccc(o2)C(=O)Nc3ccccc3I)Cl
Chemical ID:
7028793
Name [?]:
5-(2-chlorophenyl)-N-(2-iodophenyl)-furan-2-carboxamide
SMILES [?]:
c1ccc(c(c1)c2ccc(o2)C(=O)Nc3ccccc3I)Cl
InChi [?]:
InChI=1/C17H11ClINO2/c18-12-6-2-1-5-11(12)15-9-10-16(22-15)17(21)20-14-8-4-3-7-13(14)19/h1-10H,(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,2,18,17,6,3,19,16,8,9,5,4,20,15,7,10,12,22,21,14,13,11/rA:22nCCCCCCCCCCOCONCCCCCCICl/rB:s1;d2;s3;d4;d1s5;s5;d7;s8;d9;s7s10;s10;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H11ClINO2
All Atoms:33
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:10.8667
Area:517.557
Solvation:-2.07227
Coulombic:-33.4366
Bond Count [?]
All:24
Single:15
Double:9
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:423.632
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.34
LogP (Chemaxon):4.36

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Descriptor Annotations

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