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Chemical ID: 7299251

Chemical ID:

7299251

Name [?]:

N-(2,5-dimethoxyphenyl)-2-(2-methoxy-4-methyl-phenoxy)-acetamide

SMILES [?]:

Cc1ccc(c(c1)OC)OCC(=O)Nc2cc(ccc2OC)OC

InChi [?]:

InChI=1/C18H21NO5/c1-12-5-7-16(17(9-12)23-4)24-11-18(20)19-14-10-13(21-2)6-8-15(14)22-3/h5-10H,11H2,1-4H3,(H,19,20)

InChi Info:

AuxInfo=1/1/N:1,24,22,9,3,18,4,19,7,16,11,2,17,15,20,5,6,12,14,13,23,21,8,10/rA:24nCCCCCCCOCOCCONCCCCCCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s5;s10;s11;d12;s12;s14;s15;d16;s17;d18;d15s19;s20;s21;s17;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₈H₂₁NO₅
All Atoms:	45
Heavy Atoms:	24
Chiral Atoms:	0

ZAP Information [?]

Total:	5.09049
Area:	552.642
Solvation:	-8.72556
Coulombic:	-48.3627

Bond Count [?]

All:	25
Single:	18
Double:	7
Rotors:	8
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	331.363
H-Bond Donors:	1
H-Bond Acceptors:	6
XLogP:	2.59
LogP (Chemaxon):	2.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value