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Chemical ID: 4249360
Chemical ID:
4249360
Name [?]:
N-(2-acetamidophenyl)-2,3-dimethoxy-benzamide
SMILES [?]:
CC(=O)Nc1ccccc1NC(=O)c2cccc(c2OC)OC
InChi [?]:
InChI=1/C17H18N2O4/c1-11(20)18-13-8-4-5-9-14(13)19-17(21)12-7-6-10-15(22-2)16(12)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChi Info:
AuxInfo=1/1/N:1,23,21,7,8,16,15,6,9,17,2,14,5,10,18,19,12,4,11,3,13,22,20/rA:23nCCONCCCCCCNCOCCCCCCOCOC/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s10;s11;d12;s12;s14;d15;s16;d17;d14s18;s19;s20;s18;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C17H18N2O4 |
All Atoms: | 23 |
Heavy Atoms: | 23 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.43927 |
Area: | 512.559 |
Solvation: | -6.37472 |
Coulombic: | -54.4575 |
Bond Count [?]
All: | 24 |
Single: | 16 |
Double: | 8 |
Rotors: | 7 |
Chiral: | 0 |
Rigid Segments: | 6 |
Chemical Properties
Molecular Weight: | 314.336 |
H-Bond Donors: | 2 |
H-Bond Acceptors: | 6 |
XLogP: | 1.81 |
LogP (Chemaxon): | 1.92 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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