Chemical ID: 4209087

CCOc1ccc(cc1Cl)C(=O)Nc2ccccc2F
Chemical ID:
4209087
Name [?]:
3-chloro-4-ethoxy-N-(2-fluorophenyl)-benzamide
SMILES [?]:
CCOc1ccc(cc1Cl)C(=O)Nc2ccccc2F
InChi [?]:
InChI=1/C15H13ClFNO2/c1-2-20-14-8-7-10(9-11(14)16)15(19)18-13-6-4-3-5-12(13)17/h3-9H,2H2,1H3,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,2,17,16,18,15,6,5,8,7,9,19,14,4,11,10,20,13,12,3/rA:20nCCOCCCCCCClCONCCCCCCF/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s7;d11;s11;s13;s14;d15;s16;d17;d14s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H13ClFNO2
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.42228
Area:478.111
Solvation:-3.53049
Coulombic:-34.45
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:293.72
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:4.11
LogP (Chemaxon):3.2

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