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Chemical ID: 7522112

Cc1ccc(cc1)N2C(c3c(=O)c4cc(c(cc4oc3C2=O)C)C)c5ccccc5F

Chemical ID:

7522112

Name [?]:

None

SMILES [?]:

Cc1ccc(cc1)N2C(c3c(=O)c4cc(c(cc4oc3C2=O)C)C)c5ccccc5F

InChi [?]:

InChI=1/C26H20FNO3/c1-14-8-10-17(11-9-14)28-23(18-6-4-5-7-20(18)27)22-24(29)19-12-15(2)16(3)13-21(19)31-25(22)26(28)30/h4-13,23H,1-3H3

InChi Info:

AuxInfo=1/0/N:1,24,23,27,28,26,29,3,7,4,6,14,17,2,15,16,5,25,13,30,18,10,9,11,20,21,31,8,12,22,19/E:(8,9)(10,11)/rA:31cCCCCCCCNCCCOCCCCCCOCCOCCCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;d11;s11;s13;d14;s15;d16;d13s17;s18;d10s19;s8s20;d21;s16;s15;s9;s25;d26;s27;d28;d25s29;s30;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₆H₂₀FNO₃
All Atoms:	51
Heavy Atoms:	31
Chiral Atoms:	None

ZAP Information [?]

Total:	11.0032
Area:	590.858
Solvation:	-3.76824
Coulombic:	-39.6444

Bond Count [?]

All:	35
Single:	23
Double:	12
Rotors:	2
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	5.46
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