Chemical ID: 5540996

COc1ccc(cc1)C(=O)Nc2cc(ccc2F)F
Chemical ID:
5540996
Name [?]:
N-(2,5-difluorophenyl)-4-methoxy-benzamide
SMILES [?]:
COc1ccc(cc1)C(=O)Nc2cc(ccc2F)F
InChi [?]:
InChI=1/C14H11F2NO2/c1-19-11-5-2-9(3-6-11)14(18)17-13-8-10(15)4-7-12(13)16/h2-8H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,5,7,15,4,8,16,13,6,14,3,17,12,9,19,18,11,10,2/E:(2,3)(5,6)/rA:19nCOCCCCCCCONCCCCCCFF/rB:s1;s2;s3;d4;s5;d6;d3s7;s6;d9;s9;s11;s12;d13;s14;d15;d12s16;s17;s14;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11F2NO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:6.32503
Area:428.348
Solvation:-4.38368
Coulombic:-36.3246
Bond Count [?]
All:20
Single:13
Double:7
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:263.239
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:3.23
LogP (Chemaxon):2.48

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Descriptor Annotations

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