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Chemical ID: 7516482
Chemical ID:
7516482
Name [?]:
5-(3,5-dichlorophenyl)-N-(2-ethylphenyl)-2-methyl-furan-3-carboxamide
SMILES [?]:
CCc1ccccc1NC(=O)c2cc(oc2C)c3cc(cc(c3)Cl)Cl
InChi [?]:
InChI=1/C20H17Cl2NO2/c1-3-13-6-4-5-7-18(13)23-20(24)17-11-19(25-12(17)2)14-8-15(21)10-16(22)9-14/h4-11H,3H2,1-2H3,(H,23,24)
InChi Info:
AuxInfo=1/1/N:1,17,2,5,6,4,7,19,23,21,13,16,3,18,20,22,12,8,14,10,25,24,9,11,15/E:(8,9)(15,16)(21,22)/rA:25nCCCCCCCCNCOCCCOCCCCCCCCClCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;d13;s14;d12s15;s16;s14;s18;d19;s20;d21;d18s22;s22;s20;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C20H17Cl2NO2 |
All Atoms: | 42 |
Heavy Atoms: | 25 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 12.1727 |
Area: | 592.151 |
Solvation: | -2.63113 |
Coulombic: | -30.6242 |
Bond Count [?]
All: | 27 |
Single: | 18 |
Double: | 9 |
Rotors: | 5 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 5.72 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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