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Chemical ID: 7678357

c1cc(ccc1n2c3c(c(=O)n(cn3)CC(=O)Nc4ccc5c(c4)OCO5)nn2)F

Chemical ID:

7678357

Name [?]:

None

SMILES [?]:

c1cc(ccc1n2c3c(c(=O)n(cn3)CC(=O)Nc4ccc5c(c4)OCO5)nn2)F

InChi [?]:

InChI=1/C19H13FN6O4/c20-11-1-4-13(5-2-11)26-18-17(23-24-26)19(28)25(9-21-18)8-16(27)22-12-3-6-14-15(7-12)30-10-29-14/h1-7,9H,8,10H2,(H,22,27)

InChi Info:

AuxInfo=1/1/N:2,4,20,1,5,21,24,15,13,26,3,19,6,22,23,16,9,8,10,30,14,18,28,29,12,7,17,11,27,25/E:(1,2)(4,5)/rA:30nCCCCCCNCCCONCNCCONCCCCCCOCONNF/rB:s1;d2;s3;d4;d1s5;s6;s7;d8;s9;d10;s10;s12;s8d13;s12;s15;d16;s16;s18;s19;d20;s21;d22;d19s23;s23;s25;s22s26;s9;s7d28;s3;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count

Formula:	C₁₉H₁₃FN₆O₄
All Atoms:	43
Heavy Atoms:	30
Chiral Atoms:	None

ZAP Information [?]

Total:	8.48646
Area:	596.289
Solvation:	-6.42076
Coulombic:	-66.2617

Bond Count [?]

All:	34
Single:	23
Double:	11
Rotors:	5
Chiral:	None
Rigid Segments:	None

Chemical Properties

Molecular Weight:	None
H-Bond Donors:	None
H-Bond Acceptors:	None
XLogP:	1.12
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