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Chemical ID: 6965249

Cc1cccc(c1)OCC(=O)Nc2ccccc2NC(=O)COc3cccc(c3)C

Chemical ID:

6965249

Name [?]:

2-(3-methylphenoxy)-N-[2-[2-(3-methylphenoxy)acetyl]aminophenyl]-acetamide

SMILES [?]:

Cc1cccc(c1)OCC(=O)Nc2ccccc2NC(=O)COc3cccc(c3)C

InChi [?]:

InChI=1/C24H24N2O4/c1-17-7-5-9-19(13-17)29-15-23(27)25-21-11-3-4-12-22(21)26-24(28)16-30-20-10-6-8-18(2)14-20/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28)

InChi Info:

AuxInfo=1/1/N:1,30,15,16,4,26,3,27,5,25,14,17,7,29,9,22,2,28,6,24,13,18,10,20,12,19,11,21,8,23/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(29,30)/gE:(1,2)/rA:30nCCCCCCCOCCONCCCCCCNCOCOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;s19;d20;s20;s22;s23;s24;d25;s26;d27;d24s28;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₄N₂O₄
All Atoms:	54
Heavy Atoms:	30
Chiral Atoms:	0

ZAP Information [?]

Total:	9.36531
Area:	666.711
Solvation:	-7.30247
Coulombic:	-56.774

Bond Count [?]

All:	32
Single:	21
Double:	11
Rotors:	10
Chiral:	0
Rigid Segments:	7

Chemical Properties

Molecular Weight:	404.458
H-Bond Donors:	2
H-Bond Acceptors:	6
XLogP:	4.2
LogP (Chemaxon):	4.64

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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Chemical Mix	Source	External ID	Descriptor	Value

Descriptor Annotations

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Chemical Mix	Source	External ID	Descriptor	Value