The Biofilms Structural Database |
Compound 20 |
|
---|---|
6Q7W |
|
Code
HLQ | |
Name |
~{N}4-[3-(4-fluorophenyl)propyl]-6-(trifluoromethyl)pyridine-2,4-diamine |
Molecular Weight |
313.29 |
Isomeric SMILES |
Nc1cc(NCCCc2ccc(F)cc2)cc(n1)C(F)(F)F |
Formula |
C15H15F4N3 |
Identifiers |
~{N}4-[3-(4-fluorophenyl)propyl]-6-(trifluoromethyl)pyridine-2,4-diamine |
Formal Charge |
0 |
InChI |
InChI=1S/C15H15F4N3/c16-11-5-3-10(4-6-11)2-1-7-21-12-8-13(15(17,18)19)22-14(20)9-12/h3-6,8-9H,1-2,7H2,(H3,20,21,22) |
Atom Count |
37 |
InChIKey |
AUZFKJZRALGBMB-UHFFFAOYSA-N |
PDB codes |
6Q7W |
Type |
NON-POLYMER |
Chiral Atom Count |
0 |
Chiral Atoms |
n/a |
Bond Count |
38 |
Aromatic Bond Count |
12 |
Leaving Atoms |
n/a |