ChemicalDetail: Details for an Individual Chemical

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Chemical ID: 7659320

Chemical ID:

7659320

Name [?]:

None

SMILES [?]:

CN(C)CCC(c1ccccc1)Oc2ccccc2OCc3ccccc3

InChi [?]:

InChI=1/C24H27NO2/c1-25(2)18-17-22(21-13-7-4-8-14-21)27-24-16-10-9-15-23(24)26-19-20-11-5-3-6-12-20/h3-16,22H,17-19H2,1-2H3

InChi Info:

AuxInfo=1/0/N:1,3,25,10,24,26,9,11,17,16,23,27,8,12,18,15,5,4,21,22,7,6,19,14,2,20,13/E:(1,2)(5,6)(7,8)(11,12)(13,14)/rA:27cCNCCCCCCCCCCOCCCCCCOCCCCCCC/rB:s1;s2;s2;s4;s5;s6;s7;d8;s9;d10;d7s11;s6;s13;s14;d15;s16;d17;d14s18;s19;s20;s21;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₄H₂₇NO₂
All Atoms:	54
Heavy Atoms:	27
Chiral Atoms:	None

ZAP Information [?]

Total:	10.9009
Area:	618.901
Solvation:	-4.5716
Coulombic:	-24.7304

Bond Count [?]

All:	29
Single:	20
Double:	9
Rotors:	9
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.32
LogP (Chemaxon):	None

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

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

Chemical Mix	Source	External ID	Descriptor	Value