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Chemical ID: 7470332

Cc1ccc(c(c1)C)OCC(=O)NN=Cc2ccc(cc2)c3ccccc3

Chemical ID:

7470332

Name [?]:

2-(2,4-dimethylphenoxy)-N-[(4-phenylphenyl)methyleneamino]acetamide

SMILES [?]:

Cc1ccc(c(c1)C)OCC(=O)NN=Cc2ccc(cc2)c3ccccc3

InChi [?]:

InChI=1/C23H22N2O2/c1-17-8-13-22(18(2)14-17)27-16-23(26)25-24-15-19-9-11-21(12-10-19)20-6-4-3-5-7-20/h3-15H,16H2,1-2H3,(H,25,26)

InChi Info:

AuxInfo=1/1/N:1,8,25,24,26,23,27,3,17,21,18,20,4,7,15,10,2,6,16,22,19,5,11,14,13,12,9/E:(4,5)(6,7)(9,10)(11,12)/rA:27nCCCCCCCCOCCONNCCCCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;s9;s10;d11;s11;s13;w14;s15;s16;d17;s18;d19;d16s20;s19;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₂N₂O₂
All Atoms:	49
Heavy Atoms:	27
Chiral Atoms:	0

ZAP Information [?]

Total:	9.78698
Area:	623.648
Solvation:	-5.80423
Coulombic:	-28.1311

Bond Count [?]

All:	29
Single:	18
Double:	11
Rotors:	7
Chiral:	1
Rigid Segments:	6

Chemical Properties

Molecular Weight:	358.433
H-Bond Donors:	1
H-Bond Acceptors:	4
XLogP:	6.28
LogP (Chemaxon):	5.64

Name Annotations

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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