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Chemical ID: 7678420

c1cc(ccc1CNC(=O)Cn2cnc3c(c2=O)nnn3c4ccc(cc4)F)F

Chemical ID:

7678420

Name [?]:

None

SMILES [?]:

c1cc(ccc1CNC(=O)Cn2cnc3c(c2=O)nnn3c4ccc(cc4)F)F

InChi [?]:

InChI=1/C19H14F2N6O2/c20-13-3-1-12(2-4-13)9-22-16(28)10-26-11-23-18-17(19(26)29)24-25-27(18)15-7-5-14(21)6-8-15/h1-8,11H,9-10H2,(H,22,28)

InChi Info:

AuxInfo=1/1/N:1,5,2,4,24,26,23,27,7,11,13,6,3,25,22,9,16,15,17,29,28,8,14,19,20,12,21,10,18/E:(1,2)(3,4)(5,6)(7,8)/rA:29nCCCCCCCNCOCNCNCCCONNNCCCCCCFF/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;d9;s9;s11;s12;d13;s14;d15;s12s16;d17;s16;d19;s15s20;s21;s22;d23;s24;d25;d22s26;s25;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₁₄F₂N₆O₂
All Atoms:	43
Heavy Atoms:	29
Chiral Atoms:	None

ZAP Information [?]

Total:	9.28944
Area:	595.708
Solvation:	-5.60326
Coulombic:	-55.9704

Bond Count [?]

All:	32
Single:	21
Double:	11
Rotors:	6
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	1.67
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