Chemical ID: 4203180

CC(=O)Nc1cccc(c1)NC(=O)c2c(c(c(c(c2F)F)F)F)F
Chemical ID:
4203180
Name [?]:
N-(3-acetamidophenyl)-2,3,4,5,6-pentafluoro-benzamide
SMILES [?]:
CC(=O)Nc1cccc(c1)NC(=O)c2c(c(c(c(c2F)F)F)F)F
InChi [?]:
InChI=1/C15H9F5N2O2/c1-6(23)21-7-3-2-4-8(5-7)22-15(24)9-10(16)12(18)14(20)13(19)11(9)17/h2-5H,1H3,(H,21,23)(H,22,24)
InChi Info:
AuxInfo=1/1/N:1,7,6,8,10,2,5,9,14,15,19,16,18,17,12,24,20,23,21,22,4,11,3,13/E:(10,11)(12,13)(16,17)(18,19)/rA:24nCCONCCCCCCNCOCCCCCCFFFFF/rB:s1;d2;s2;s4;s5;d6;s7;d8;d5s9;s9;s11;d12;s12;s14;d15;s16;d17;d14s18;s19;s18;s17;s16;s15;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H9F5N2O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:3.96919
Area:487.773
Solvation:-8.22514
Coulombic:-50.7376
Bond Count [?]
All:25
Single:17
Double:8
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:344.236
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.05
LogP (Chemaxon):3.13

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