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Chemical ID: 7519048
Chemical ID:
7519048
Name [?]:
N-(3-chloro-2-methyl-phenyl)-3,4,6-trimethyl-benzofuran-2-carboxamide
SMILES [?]:
Cc1cc(c2c(c(oc2c1)C(=O)Nc3cccc(c3C)Cl)C)C
InChi [?]:
InChI=1/C19H18ClNO2/c1-10-8-11(2)17-13(4)18(23-16(17)9-10)19(22)21-15-7-5-6-14(20)12(15)3/h5-9H,1-4H3,(H,21,22)
InChi Info:
AuxInfo=1/1/N:1,23,20,22,16,17,15,3,10,2,4,19,6,18,14,9,5,7,11,21,13,12,8/rA:23nCCCCCCCOCCCONCCCCCCCClCC/rB:s1;s2;d3;s4;s5;d6;s7;d5s8;d2s9;s7;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s18;s6;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C19H18ClNO2 |
All Atoms: | 41 |
Heavy Atoms: | 23 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 11.4741 |
Area: | 521.43 |
Solvation: | -1.56168 |
Coulombic: | -32.8855 |
Bond Count [?]
All: | 25 |
Single: | 17 |
Double: | 8 |
Rotors: | 3 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 4.92 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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