CC1=C(C2=C(C(=C1C3=CC=CC=C3)F)OC(=N2)C(=O)N(C)C)C#N
Nombre: 4-cyano-7-fluoro-N,N,5-trimethyl-6-phenyl-1,3-benzoxazole-2-carboxamide
SMILES: CC1=C(C2=C(C(=C1C3=CC=CC=C3)F)OC(=N2)C(=O)N(C)C)C#N

Molecular Processing

Molecular formula
C18H14FN3O2
Molecular weight
323.33
Exact mass
323.107
XLogP
3.52
TPSA
70.13
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
86.87

Supplementary Information

InChIKey: MWXDJAHDKDOKIH-UHFFFAOYSA-N
Sinónimos
SCHEMBL3296695MWXDJAHDKDOKIH-UHFFFAOYSA-N4-Cyano-7-fluoro-N,N,5-trimethyl-6-phenyl-1,3-benzoxazole-2-carboxamide
Ver fuente →
Participa en 12 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→