Chemical ID: 7667438

COc1ccc(cc1OC)CC2c3cc(c(cc3CCN2C(=O)c4cccc(c4)C(F)(F)F)OC)OC
Chemical ID:
7667438
Name [?]:
None
SMILES [?]:
COc1ccc(cc1OC)CC2c3cc(c(cc3CCN2C(=O)c4cccc(c4)C(F)(F)F)OC)OC
InChi [?]:
InChI=1/C28H28F3NO5/c1-34-23-9-8-17(13-24(23)35-2)12-22-21-16-26(37-4)25(36-3)15-18(21)10-11-32(22)27(33)19-6-5-7-20(14-19)28(29,30)31/h5-9,13-16,22H,10-12H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,10,35,37,26,25,27,5,4,19,20,11,7,29,17,14,6,18,24,28,13,12,3,8,16,15,22,30,31,32,33,21,23,2,9,34,36/E:(29,30,31)/rA:37cCOCCCCCCOCCCCCCCCCCCNCOCCCCCCCFFFOCOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s6;s11;s12;s13;d14;s15;d16;d13s17;s18;s19;s12s20;s21;d22;s22;s24;d25;s26;d27;d24s28;s28;s30;s30;s30;s16;s34;s15;s36;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C28H28F3NO5
All Atoms:65
Heavy Atoms:37
Chiral Atoms:None
ZAP Information [?]
Total:7.13371
Area:668.722
Solvation:-9.58435
Coulombic:-65.1424
Bond Count [?]
All:40
Single:30
Double:10
Rotors:9
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:5.14
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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