Chemical ID: 7421294

c1cc2c(cc1C(=O)Nc3ccc(c(c3)F)F)[nH]cn2
Chemical ID:
7421294
Name [?]:
N-(3,4-difluorophenyl)-3H-benzoimidazole-5-carboxamide
SMILES [?]:
c1cc2c(cc1C(=O)Nc3ccc(c(c3)F)F)[nH]cn2
InChi [?]:
InChI=1/C14H9F2N3O/c15-10-3-2-9(6-11(10)16)19-14(20)8-1-4-12-13(5-8)18-7-17-12/h1-7H,(H,17,18)(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,11,12,2,5,15,19,6,10,13,14,3,4,7,17,16,20,18,9,8/rA:20nCCCCCCCONCCCCCCFFNCN/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s9;s10;d11;s12;d13;d10s14;s14;s13;s4;s18;s3d19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H9F2N3O
All Atoms:29
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:6.59487
Area:432.215
Solvation:-4.21052
Coulombic:-43.8491
Bond Count [?]
All:22
Single:14
Double:8
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:273.238
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.61
LogP (Chemaxon):2.88

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