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Chemical ID: 5371639
Chemical ID:
5371639
Name [?]:
N-(5-fluoro-2-methyl-phenyl)-2-phenoxy-benzamide
SMILES [?]:
Cc1ccc(cc1NC(=O)c2ccccc2Oc3ccccc3)F
InChi [?]:
InChI=1/C20H16FNO2/c1-14-11-12-15(21)13-18(14)22-20(23)17-9-5-6-10-19(17)24-16-7-3-2-4-8-16/h2-13H,1H3,(H,22,23)
InChi Info:
AuxInfo=1/1/N:1,21,20,22,13,14,19,23,12,15,3,4,6,2,5,18,11,7,16,9,24,8,10,17/E:(3,4)(7,8)/rA:24nCCCCCCCNCOCCCCCCOCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s16;s17;s18;d19;s20;d21;d18s22;s5;/rC:;;;;;;;;;;;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C20H16FNO2 |
All Atoms: | 24 |
Heavy Atoms: | 24 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 8.67011 |
Area: | 510.563 |
Solvation: | -4.09396 |
Coulombic: | -34.2114 |
Bond Count [?]
All: | 26 |
Single: | 16 |
Double: | 10 |
Rotors: | 5 |
Chiral: | 0 |
Rigid Segments: | 4 |
Chemical Properties
Molecular Weight: | 321.345 |
H-Bond Donors: | 1 |
H-Bond Acceptors: | 3 |
XLogP: | 4.86 |
LogP (Chemaxon): | 4.49 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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