Chemical ID: 7688783

CC1(CC2CC(C1)(CN2c3nc(cc(n3)C(F)(F)F)c4cccc(c4)OC)C)C
Chemical ID:
7688783
Name [?]:
None
SMILES [?]:
CC1(CC2CC(C1)(CN2c3nc(cc(n3)C(F)(F)F)c4cccc(c4)OC)C)C
InChi [?]:
InChI=1/C22H26F3N3O/c1-20(2)10-15-11-21(3,12-20)13-28(15)19-26-17(9-18(27-19)22(23,24)25)14-6-5-7-16(8-14)29-4/h5-9,15H,10-13H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,29,28,27,22,21,23,25,13,3,5,7,8,20,4,24,12,14,10,2,6,16,17,18,19,11,15,9,26/E:(1,2)(23,24,25)/rA:29cCCCCCCCCNCNCCCNCFFFCCCCCCOCCC/rB:s1;s2;s3;s4;s5;s2s6;s6;s4s8;s9;s10;d11;s12;d13;d10s14;s14;s16;s16;s16;s12;s20;d21;s22;d23;d20s24;s24;s26;s6;s2;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H26F3N3O
All Atoms:55
Heavy Atoms:29
Chiral Atoms:None
ZAP Information [?]
Total:10.7136
Area:575.536
Solvation:-3.67481
Coulombic:-46.8606
Bond Count [?]
All:32
Single:26
Double:6
Rotors:4
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:6.41
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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