Chemical ID: 6943471

CCOc1cccc(c1)C(=O)Nc2ccc(cc2F)F
Chemical ID:
6943471
Name [?]:
N-(2,4-difluorophenyl)-3-ethoxy-benzamide
SMILES [?]:
CCOc1cccc(c1)C(=O)Nc2ccc(cc2F)F
InChi [?]:
InChI=1/C15H13F2NO2/c1-2-20-12-5-3-4-10(8-12)15(19)18-14-7-6-11(16)9-13(14)17/h3-9H,2H2,1H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,6,7,5,15,14,9,17,8,16,4,18,13,10,20,19,12,11,3/rA:20nCCOCCCCCCCONCCCCCCFF/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s8;d10;s10;s12;s13;d14;s15;d16;d13s17;s18;s16;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H13F2NO2
All Atoms:33
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.18193
Area:455.796
Solvation:-4.21297
Coulombic:-36.4752
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:277.266
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.65
LogP (Chemaxon):2.82

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Descriptor Annotations

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