Chemical ID: 6401455

Cc1c(cccc1Cl)NC(=O)c2cccc(c2)F
Chemical ID:
6401455
Name [?]:
N-(3-chloro-2-methyl-phenyl)-3-fluoro-benzamide
SMILES [?]:
Cc1c(cccc1Cl)NC(=O)c2cccc(c2)F
InChi [?]:
InChI=1/C14H11ClFNO/c1-9-12(15)6-3-7-13(9)17-14(18)10-4-2-5-11(16)8-10/h2-8H,1H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,14,5,13,15,6,4,17,2,12,16,7,3,10,8,18,9,11/rA:18nCCCCCCCClNCOCCCCCCF/rB:s1;s2;d3;s4;d5;d2s6;s7;s3;s9;d10;s10;s12;d13;s14;d15;d12s16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11ClFNO
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.2648
Area:430.757
Solvation:-2.50414
Coulombic:-26.6953
Bond Count [?]
All:19
Single:12
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:263.694
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:4.0
LogP (Chemaxon):3.58

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