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Chemical ID: 7678076

Cc1ccc(cc1)n2c3c(c(=O)n(cn3)CC(=O)NCCc4ccc(c(c4)OC)OC)nn2

Chemical ID:

7678076

Name [?]:

None

SMILES [?]:

Cc1ccc(cc1)n2c3c(c(=O)n(cn3)CC(=O)NCCc4ccc(c(c4)OC)OC)nn2

InChi [?]:

InChI=1/C23H24N6O4/c1-15-4-7-17(8-5-15)29-22-21(26-27-29)23(31)28(14-25-22)13-20(30)24-11-10-16-6-9-18(32-2)19(12-16)33-3/h4-9,12,14H,10-11,13H2,1-3H3,(H,24,30)

InChi Info:

AuxInfo=1/1/N:1,31,29,3,7,23,4,6,24,21,20,27,16,14,2,22,5,25,26,17,10,9,11,19,15,32,33,13,8,18,12,30,28/E:(4,5)(7,8)/rA:33nCCCCCCCNCCCONCNCCONCCCCCCCCOCOCNN/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s10;d11;s11;s13;s9d14;s13;s16;d17;s17;s19;s20;s21;s22;d23;s24;d25;d22s26;s26;s28;s25;s30;s10;s8d32;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₄N₆O₄
All Atoms:	57
Heavy Atoms:	33
Chiral Atoms:	None

ZAP Information [?]

Total:	10.0773
Area:	705.439
Solvation:	-7.55869
Coulombic:	-62.454

Bond Count [?]

All:	36
Single:	25
Double:	11
Rotors:	9
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	1.51
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