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Chemical ID: 7267569

Chemical ID:

7267569

Name [?]:

(3,5-dimethoxy-4-methyl-phenyl)-(2,6-dimethylmorpholin-4-yl)-methanone

SMILES [?]:

Cc1c(cc(cc1OC)C(=O)N2CC(OC(C2)C)C)OC

InChi [?]:

InChI=1/C16H23NO4/c1-10-8-17(9-11(2)21-10)16(18)13-6-14(19-4)12(3)15(7-13)20-5/h6-7,10-11H,8-9H2,1-5H3

InChi Info:

AuxInfo=1/0/N:18,19,1,9,21,6,4,17,13,16,14,2,5,7,3,10,12,11,8,20,15/E:(1,2)(4,5)(6,7)(8,9)(10,11)(14,15)(19,20)/rA:21cCCCCCCCOCCONCCOCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s5;d10;s10;s12;s13;s14;s15;s12s16;s16;s14;s3;s20;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₆H₂₃NO₄
All Atoms:	44
Heavy Atoms:	21
Chiral Atoms:	2

ZAP Information [?]

Total:	6.90436
Area:	482.78
Solvation:	-5.16513
Coulombic:	-38.8704

Bond Count [?]

All:	22
Single:	18
Double:	4
Rotors:	4
Chiral:	0
Rigid Segments:	5

Chemical Properties

Molecular Weight:	293.358
H-Bond Donors:	0
H-Bond Acceptors:	5
XLogP:	2.14
LogP (Chemaxon):	1.64

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