CC1(C)N=CC2=C3N=C(Cc4ccccc4)N=C3C(=O)CC2C1=O
Nombre: 2-benzyl-7,7-dimethyl-5,5a-dihydroimidazo[4,5-h]isoquinoline-4,6-dione
SMILES: CC1(C)N=CC2=C3N=C(Cc4ccccc4)N=C3C(=O)CC2C1=O

Molecular Processing

Molecular formula
C19H17N3O2
Molecular weight
319.36
Exact mass
319.1321
XLogP
2.36
TPSA
71.22
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
24
Rings
4
Aromatic rings
1
Saturated rings
0
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.316
Molar refractivity
92.73

Supplementary Information

InChIKey: PFMQAVBPSYMVOR-UHFFFAOYSA-N
Sinónimos
SCHEMBL11560088PFMQAVBPSYMVOR-UHFFFAOYSA-N7,7-dimethyl-2-benzyl-5H,7H-imidazo[4,5-h]isoquinoline-4,6-dione
Ver fuente →
Participa en 2 reacciones→

Busqueda Extendida

Busqueda de Subestructura→Busqueda de Similitud→