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Chemical ID: 7435300
Chemical ID:
7435300
Name [?]:
5-(3,4-dichlorophenyl)-N-(2-methoxyphenyl)-2-methyl-furan-3-carboxamide
SMILES [?]:
Cc1c(cc(o1)c2ccc(c(c2)Cl)Cl)C(=O)Nc3ccccc3OC
InChi [?]:
InChI=1/C19H15Cl2NO3/c1-11-13(19(23)22-16-5-3-4-6-17(16)24-2)10-18(25-11)12-7-8-14(20)15(21)9-12/h3-10H,1-2H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,25,20,21,19,22,8,9,12,4,2,7,3,10,11,18,23,5,15,14,13,17,16,24,6/rA:25nCCCCCOCCCCCCClClCONCCCCCCOC/rB:s1;d2;s3;d4;s2s5;s5;s7;d8;s9;d10;d7s11;s11;s10;s3;d15;s15;s17;s18;d19;s20;d21;d18s22;s23;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H15Cl2NO3 |
All Atoms: | 40 |
Heavy Atoms: | 25 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 10.9382 |
Area: | 582.483 |
Solvation: | -3.62384 |
Coulombic: | -38.0305 |
Bond Count [?]
All: | 27 |
Single: | 18 |
Double: | 9 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 5 |
Chemical Properties
Molecular Weight: | 376.233 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 4.95 |
LogP (Chemaxon): | 4.53 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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