C1CNC(=O)C2=C3C1=C(NC3=CC=C2)C4=CC=CC=C4
CAS: 283172-68-9
الاسم: 2-phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-one
SMILES: C1CNC(=O)C2=C3C1=C(NC3=CC=C2)C4=CC=CC=C4

Molecular Processing

Molecular formula
C17H14N2O
Molecular weight
262.31
Exact mass
262.1106
XLogP
3.12
TPSA
44.89
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
20
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.118
Molar refractivity
79.77

Supplementary Information

InChIKey: CMVVSYUUFABRBC-UHFFFAOYSA-N
مرادفات
WD2000-012547283172-68-9CHEMBL1476632-Phenyl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraen-9-oneorb1708231SCHEMBL5002723SCHEMBL29369918CMVVSYUUFABRBC-UHFFFAOYSA-N2-Phenyl-1,3,4,5-tetrahydro-azepino[5,4,3-cd]indol-6-oneBDBM50120724HY-U00223AKOS040740559CS-7370T133332-Phenyl-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indol-6-one5-Phenyl-2,3,4,6-tetrahydro-1H-azepino[5,4,3-cd]indol-1-one
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