The Biofilms Structural Database
|
|
The Biofilms Structural Database |
Antagomist 12 |
|
|---|---|
6Z07 |
|
Code
Q4E | |
|
Name |
3-[(2-~{tert}-butyl-1,3-thiazol-4-yl)methyl]-6-chloranyl-quinazolin-4-one |
|
Molecular Weight |
333.84 |
|
Isomeric SMILES |
CC(C)(C)c1nc(cs1)CN2C=Nc3ccc(cc3C2=O)Cl |
|
Formula |
C16H16ClN3OS |
|
Identifiers |
3-[(2-~{tert}-butyl-1,3-thiazol-4-yl)methyl]-6-chloranyl-quinazolin-4-one |
|
Formal Charge |
0 |
|
InChI |
InChI=1S/C16H16ClN3OS/c1-16(2,3)15-19-11(8-22-15)7-20-9-18-13-5-4-10(17)6-12(13)14(20)21/h4-6,8-9H,7H2,1-3H3 |
|
Atom Count |
38 |
|
InChIKey |
FGNPKMRRBOIDGA-UHFFFAOYSA-N |
|
PDB codes |
6Z07 |
|
Type |
NON-POLYMER |
|
Chiral Atom Count |
0 |
|
Chiral Atoms |
n/a |
|
Bond Count |
40 |
|
Aromatic Bond Count |
11 |
|
Leaving Atoms |
n/a |