Chemical ID: 7718039

Cc1ccc(cc1C)NC(=O)c2c(n(nn2)c3cccc(c3)C(F)(F)F)C
Chemical ID:
7718039
Name [?]:
None
SMILES [?]:
Cc1ccc(cc1C)NC(=O)c2c(n(nn2)c3cccc(c3)C(F)(F)F)C
InChi [?]:
InChI=1/C19H17F3N4O/c1-11-7-8-15(9-12(11)2)23-18(27)17-13(3)26(25-24-17)16-6-4-5-14(10-16)19(20,21)22/h4-10H,1-3H3,(H,23,27)
InChi Info:
AuxInfo=1/1/N:1,8,27,19,20,18,3,4,6,22,2,7,13,21,5,17,12,10,23,24,25,26,9,16,15,14,11/E:(20,21,22)/rA:27nCCCCCCCCNCOCCNNNCCCCCCCFFFC/rB:s1;s2;d3;s4;d5;d2s6;s7;s5;s9;d10;s10;d12;s13;s14;s12d15;s14;s17;d18;s19;d20;d17s21;s21;s23;s23;s23;s13;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H17F3N4O
All Atoms:44
Heavy Atoms:27
Chiral Atoms:None
ZAP Information [?]
Total:11.1446
Area:558.826
Solvation:-2.82609
Coulombic:-45.8416
Bond Count [?]
All:29
Single:20
Double:9
Rotors:5
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:4.48
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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