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Chemical ID: 7674558

Cc1cc(c2c(nn(c2n1)c3ccccc3)C)C(=O)Nc4ccc(cc4)OC(F)F

Chemical ID:

7674558

Name [?]:

None

SMILES [?]:

Cc1cc(c2c(nn(c2n1)c3ccccc3)C)C(=O)Nc4ccc(cc4)OC(F)F

InChi [?]:

InChI=1/C22H18F2N4O2/c1-13-12-18(21(29)26-15-8-10-17(11-9-15)30-22(23)24)19-14(2)27-28(20(19)25-13)16-6-4-3-5-7-16/h3-12,22H,1-2H3,(H,26,29)

InChi Info:

AuxInfo=1/1/N:1,17,14,13,15,12,16,22,26,23,25,3,2,6,21,11,24,4,5,9,18,28,29,30,10,20,7,8,19,27/E:(4,5)(6,7)(8,9)(10,11)(23,24)/rA:30nCCCCCCNNCNCCCCCCCCONCCCCCCOCFF/rB:s1;s2;d3;s4;s5;d6;s7;d5s8;d2s9;s8;s11;d12;s13;d14;d11s15;s6;s4;d18;s18;s20;s21;d22;s23;d24;d21s25;s24;s27;s28;s28;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₂H₁₈F₂N₄O₂
All Atoms:	48
Heavy Atoms:	30
Chiral Atoms:	None

ZAP Information [?]

Total:	10.1907
Area:	595.151
Solvation:	-4.68805
Coulombic:	-51.2765

Bond Count [?]

All:	33
Single:	22
Double:	11
Rotors:	6
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.05
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