Chemical ID: 6397082

COc1ccc(c(c1)OC)NC(=O)c2cc(c(c(c2)OC)OC)OC
Chemical ID:
6397082
Name [?]:
N-(2,4-dimethoxyphenyl)-3,4,5-trimethoxy-benzamide
SMILES [?]:
COc1ccc(c(c1)OC)NC(=O)c2cc(c(c(c2)OC)OC)OC
InChi [?]:
InChI=1/C18H21NO6/c1-21-12-6-7-13(14(10-12)22-2)19-18(20)11-8-15(23-3)17(25-5)16(9-11)24-4/h6-10H,1-5H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,10,21,25,23,4,5,19,15,8,14,3,6,7,18,16,17,12,11,13,2,9,20,24,22/E:(3,4)(8,9)(15,16)(23,24)/rA:25nCOCCCCCCOCNCOCCCCCCOCOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;s6;s11;d12;s12;s14;d15;s16;d17;d14s18;s18;s20;s17;s22;s16;s24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H21NO6
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:5.76962
Area:555.659
Solvation:-8.12186
Coulombic:-56.6702
Bond Count [?]
All:26
Single:19
Double:7
Rotors:8
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:347.362
H-Bond Donors:1
H-Bond Acceptors:7
XLogP:2.17
LogP (Chemaxon):1.84

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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