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Chemical ID: 7674616

Cc1ccc(cc1)Cn2ccc(n2)NC(=O)c3cc(nc4c3c(nn4C)C)C5CC5

Chemical ID:

7674616

Name [?]:

None

SMILES [?]:

Cc1ccc(cc1)Cn2ccc(n2)NC(=O)c3cc(nc4c3c(nn4C)C)C5CC5

InChi [?]:

InChI=1/C23H24N6O/c1-14-4-6-16(7-5-14)13-29-11-10-20(27-29)25-23(30)18-12-19(17-8-9-17)24-22-21(18)15(2)26-28(22)3/h4-7,10-12,17H,8-9,13H2,1-3H3,(H,25,27,30)

InChi Info:

AuxInfo=1/1/N:1,27,26,3,7,4,6,29,30,11,10,18,8,2,23,5,28,17,19,12,22,21,15,20,14,24,13,25,9,16/E:(4,5)(6,7)(8,9)/rA:30nCCCCCCCCNCCCNNCOCCCNCCCNNCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;d10;s11;s9d12;s12;s14;d15;s15;s17;d18;s19;d20;d17s21;s22;d23;s21s24;s25;s23;s19;s28;s28s29;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₂₄N₆O
All Atoms:	54
Heavy Atoms:	30
Chiral Atoms:	None

ZAP Information [?]

Total:	12.2377
Area:	638.988
Solvation:	-3.737
Coulombic:	-36.0558

Bond Count [?]

All:	34
Single:	24
Double:	10
Rotors:	6
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	4.11
LogP (Chemaxon):	None

Name Annotations

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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