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Chemical ID: 7703026

Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)C(C)Oc3ccc4ccccc4c3

Chemical ID:

7703026

Name [?]:

None

SMILES [?]:

Cc1ccc(cc1)COc2ccc(cc2)C=NNC(=O)C(C)Oc3ccc4ccccc4c3

InChi [?]:

InChI=1/C28H26N2O3/c1-20-7-9-23(10-8-20)19-32-26-14-11-22(12-15-26)18-29-30-28(31)21(2)33-27-16-13-24-5-3-4-6-25(24)17-27/h3-18,21H,19H2,1-2H3,(H,30,31)

InChi Info:

AuxInfo=1/1/N:1,22,29,30,28,31,3,7,4,6,12,14,26,11,15,25,33,16,8,2,21,13,5,27,32,10,24,19,17,18,20,9,23/E:(7,8)(9,10)(11,12)(14,15)/rA:33cCCCCCCCCOCCCCCCCNNCOCCOCCCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s12;d13;d10s14;s13;w16;s17;s18;d19;s19;s21;s21;s23;s24;d25;s26;s27;d28;s29;d30;d27s31;d24s32;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₈H₂₆N₂O₃
All Atoms:	59
Heavy Atoms:	33
Chiral Atoms:	None

ZAP Information [?]

Total:	10.8656
Area:	704.1
Solvation:	-6.73687
Coulombic:	-36.859

Bond Count [?]

All:	36
Single:	23
Double:	13
Rotors:	9
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	7.53
LogP (Chemaxon):	None

Name Annotations

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

Chemical	Mix Source	External ID	Descriptor	Value

Experimental Annotations

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

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