Chemical ID: 7678490

Cc1ccc(c(c1)Cn2cnc3c(c2=O)nnn3c4ccc(cc4)F)C
Chemical ID:
7678490
Name [?]:
None
SMILES [?]:
Cc1ccc(c(c1)Cn2cnc3c(c2=O)nnn3c4ccc(cc4)F)C
InChi [?]:
InChI=1/C19H16FN5O/c1-12-3-4-13(2)14(9-12)10-24-11-21-18-17(19(24)26)22-23-25(18)16-7-5-15(20)6-8-16/h3-9,11H,10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,26,3,4,21,23,20,24,7,8,10,2,5,6,22,19,13,12,14,25,11,16,17,9,18,15/E:(5,6)(7,8)/rA:26nCCCCCCCCNCNCCCONNNCCCCCCFC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s11;d12;s9s13;d14;s13;d16;s12s17;s18;s19;d20;s21;d22;d19s23;s22;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16FN5O
All Atoms:42
Heavy Atoms:26
Chiral Atoms:None
ZAP Information [?]
Total:10.0765
Area:529.049
Solvation:-3.14976
Coulombic:-32.7975
Bond Count [?]
All:29
Single:19
Double:10
Rotors:3
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.21
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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