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Chemical ID: 5901155
Chemical ID:
5901155
Name [?]:
N-(4-methoxyphenyl)-2-(2-phenoxyacetyl)amino-acetamide
SMILES [?]:
COc1ccc(cc1)NC(=O)CNC(=O)COc2ccccc2
InChi [?]:
InChI=1/C17H18N2O4/c1-22-14-9-7-13(8-10-14)19-16(20)11-18-17(21)12-23-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,18,21)(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,21,20,22,19,23,5,7,4,8,12,16,6,3,18,10,14,13,9,11,15,2,17/E:(3,4)(5,6)(7,8)(9,10)/rA:23nCOCCCCCCNCOCNCOCOCCCCCC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;s12;s13;d14;s14;s16;s17;s18;d19;s20;d21;d18s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H18N2O4 |
All Atoms: | 23 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 7.59986 |
Area: | 546.444 |
Solvation: | -6.06125 |
Coulombic: | -56.3137 |
Bond Count [?]
All: | 24 |
Single: | 16 |
Double: | 8 |
Rotors: | 9 |
Chiral: | 0 |
Rigid Segments: | 7 |
Chemical Properties
Molecular Weight: | 314.336 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 6 |
XLogP: | 1.76 |
LogP (Chemaxon): | 1.55 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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