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Chemical ID: 7710314

CC1=C(C(n2c(nc(n2)c3ccc(cc3)OC)N1)c4ccc(cc4)OC)C(=O)Nc5cccnc5

Chemical ID:

7710314

Name [?]:

None

SMILES [?]:

CC1=C(C(n2c(nc(n2)c3ccc(cc3)OC)N1)c4ccc(cc4)OC)C(=O)Nc5cccnc5

InChi [?]:

InChI=1/C26H24N6O3/c1-16-22(25(33)29-19-5-4-14-27-15-19)23(17-6-10-20(34-2)11-7-17)32-26(28-16)30-24(31-32)18-8-12-21(35-3)13-9-18/h4-15,23H,1-3H3,(H,29,33)(H,28,30,31)

InChi Info:

AuxInfo=1/1/N:1,26,17,32,31,20,24,11,15,21,23,12,14,33,35,2,19,10,30,22,13,3,4,8,27,6,34,18,29,7,9,5,28,25,16/E:(6,7)(8,9)(10,11)(12,13)/rA:35cCCCCNCNCNCCCCCCOCNCCCCCCOCCONCCCCNC/rB:s1;d2;s3;s4;s5;d6;s7;s5d8;s8;s10;d11;s12;d13;d10s14;s13;s16;s2s6;s4;s19;d20;s21;d22;d19s23;s22;s25;s3;d27;s27;s29;s30;d31;s32;d33;d30s34;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₆H₂₄N₆O₃
All Atoms:	59
Heavy Atoms:	35
Chiral Atoms:	None

ZAP Information [?]

Total:	11.318
Area:	690.512
Solvation:	-5.94477
Coulombic:	-64.9816

Bond Count [?]

All:	39
Single:	26
Double:	13
Rotors:	7
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	3.7
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