Chemical ID: 6847426

Cc1cc(c2c(c1)oc(c(c2=O)OCC(=O)Nc3ccccc3F)c4ccc(cc4)OC)C
Chemical ID:
6847426
Name [?]:
N-(2-fluorophenyl)-2-[2-(4-methoxyphenyl)-5,7-dimethyl-4-oxo-chromen-3-yl]oxy-acetamide
SMILES [?]:
Cc1cc(c2c(c1)oc(c(c2=O)OCC(=O)Nc3ccccc3F)c4ccc(cc4)OC)C
InChi [?]:
InChI=1/C26H22FNO5/c1-15-12-16(2)23-21(13-15)33-25(17-8-10-18(31-3)11-9-17)26(24(23)30)32-14-22(29)28-20-7-5-4-6-19(20)27/h4-13H,14H2,1-3H3,(H,28,29)
InChi Info:
AuxInfo=1/1/N:1,33,32,21,20,22,19,26,30,27,29,3,7,14,2,4,25,28,23,18,6,15,5,11,9,10,24,17,16,12,31,13,8/E:(8,9)(10,11)/rA:33nCCCCCCCOCCCOOCCONCCCCCCFCCCCCCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s5s10;d11;s10;s13;s14;d15;s15;s17;s18;d19;s20;d21;d18s22;s23;s9;s25;d26;s27;d28;d25s29;s28;s31;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C26H22FNO5
All Atoms:55
Heavy Atoms:33
Chiral Atoms:0
ZAP Information [?]
Total:10.1106
Area:660.562
Solvation:-6.40347
Coulombic:-58.7581
Bond Count [?]
All:36
Single:24
Double:12
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:447.455
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:5.56
LogP (Chemaxon):4.62

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Descriptor Annotations

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