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Chemical ID: 7705241

COc1ccc(cc1)NC(=O)C(=O)NN=Cc2ccc(cc2)OC(=O)c3ccccc3F

Chemical ID:

7705241

Name [?]:

None

SMILES [?]:

COc1ccc(cc1)NC(=O)C(=O)NN=Cc2ccc(cc2)OC(=O)c3ccccc3F

InChi [?]:

InChI=1/C23H18FN3O5/c1-31-17-12-8-16(9-13-17)26-21(28)22(29)27-25-14-15-6-10-18(11-7-15)32-23(30)19-4-2-3-5-20(19)24/h2-14H,1H3,(H,26,28)(H,27,29)

InChi Info:

AuxInfo=1/1/N:1,28,29,27,30,18,22,5,7,19,21,4,8,16,17,6,3,20,26,31,10,12,24,32,15,9,14,11,13,25,2,23/E:(6,7)(8,9)(10,11)(12,13)/rA:32nCOCCCCCCNCOCONNCCCCCCCOCOCCCCCCF/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;s9;d10;s10;d12;s12;s14;w15;s16;s17;d18;s19;d20;d17s21;s20;s23;d24;s24;s26;d27;s28;d29;d26s30;s31;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₂₃H₁₈FN₃O₅
All Atoms:	50
Heavy Atoms:	32
Chiral Atoms:	None

ZAP Information [?]

Total:	10.7919
Area:	688.629
Solvation:	-6.42386
Coulombic:	-74.2857

Bond Count [?]

All:	34
Single:	21
Double:	13
Rotors:	10
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	4.6
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