Chemical ID: 4174940

COc1ccc(cc1OC)C(=O)Nc2ccccc2F
Chemical ID:
4174940
Name [?]:
N-(2-fluorophenyl)-3,4-dimethoxy-benzamide
SMILES [?]:
COc1ccc(cc1OC)C(=O)Nc2ccccc2F
InChi [?]:
InChI=1/C15H14FNO3/c1-19-13-8-7-10(9-14(13)20-2)15(18)17-12-6-4-3-5-11(12)16/h3-9H,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,10,17,16,18,15,5,4,7,6,19,14,3,8,11,20,13,12,2,9/rA:20nCOCCCCCCOCCONCCCCCCF/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;s6;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H14FNO3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:5.88288
Area:455.704
Solvation:-5.50973
Coulombic:-40.1391
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:275.275
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.72
LogP (Chemaxon):2.09

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Descriptor Annotations

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