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Chemical ID: 4308595
Chemical ID:
4308595
Name [?]:
2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)-acetamide
SMILES [?]:
COc1ccc(cc1)OCC(=O)Nc2ccccc2OC
InChi [?]:
InChI=1/C16H17NO4/c1-19-12-7-9-13(10-8-12)21-11-16(18)17-14-5-3-4-6-15(14)20-2/h3-10H,11H2,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,21,16,17,15,18,4,8,5,7,10,3,6,14,19,11,13,12,2,20,9/E:(7,8)(9,10)/rA:21nCOCCCCCCOCCONCCCCCCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;s10;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;s20;/rC:;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C16H17NO4 |
All Atoms: | 21 |
Heavy Atoms: | 21 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.31979 |
Area: | 496.109 |
Solvation: | -6.08293 |
Coulombic: | -43.0102 |
Bond Count [?]
All: | 22 |
Single: | 15 |
Double: | 7 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 287.311 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 5 |
XLogP: | 2.51 |
LogP (Chemaxon): | 2.37 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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