Chemical ID: 4083663

Cc1ccc(cc1C)NC(=O)c2cc(c(c(c2)OC)OC)OC
Chemical ID:
4083663
Name [?]:
N-(3,4-dimethylphenyl)-3,4,5-trimethoxy-benzamide
SMILES [?]:
Cc1ccc(cc1C)NC(=O)c2cc(c(c(c2)OC)OC)OC
InChi [?]:
InChI=1/C18H21NO4/c1-11-6-7-14(8-12(11)2)19-18(20)13-9-15(21-3)17(23-5)16(10-13)22-4/h6-10H,1-5H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,8,19,23,21,3,4,6,17,13,2,7,12,5,16,14,15,10,9,11,18,22,20/E:(3,4)(9,10)(15,16)(21,22)/rA:23nCCCCCCCCNCOCCCCCCOCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;s12;d13;s14;d15;d12s16;s16;s18;s15;s20;s14;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H21NO4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:6.75833
Area:524.452
Solvation:-6.35297
Coulombic:-42.3569
Bond Count [?]
All:24
Single:17
Double:7
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:315.364
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:3.21
LogP (Chemaxon):3.28

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Descriptor Annotations

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