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Chemical ID: 7511565
Chemical ID:
7511565
Name [?]:
N-[4-(3-methoxybenzoyl)aminophenyl]-4-methyl-benzamide
SMILES [?]:
Cc1ccc(cc1)C(=O)Nc2ccc(cc2)NC(=O)c3cccc(c3)OC
InChi [?]:
InChI=1/C22H20N2O3/c1-15-6-8-16(9-7-15)21(25)23-18-10-12-19(13-11-18)24-22(26)17-4-3-5-20(14-17)27-2/h3-14H,1-2H3,(H,23,25)(H,24,26)
InChi Info:
AuxInfo=1/1/N:1,27,22,21,23,3,7,4,6,12,16,13,15,25,2,5,20,11,14,24,8,18,10,17,9,19,26/E:(6,7)(8,9)(10,11)(12,13)/rA:27nCCCCCCCCONCCCCCCNCOCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s8;s10;s11;d12;s13;d14;d11s15;s14;s17;d18;s18;s20;d21;s22;d23;d20s24;s24;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C22H20N2O3 |
All Atoms: | 47 |
Heavy Atoms: | 27 |
Chiral Atoms: | None |
ZAP Information [?]
Total: | 10.4555 |
Area: | 596.542 |
Solvation: | -4.45809 |
Coulombic: | -51.0321 |
Bond Count [?]
All: | 29 |
Single: | 18 |
Double: | 11 |
Rotors: | 7 |
Chiral: | None |
Rigid Segments: | None |
Chemical Properties
Molecular Weight: | None |
H-Bond Donors: | None |
H-Bond Acceptors: | None |
XLogP: | 3.89 |
LogP (Chemaxon): | None |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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