Name: 5,6,8,9,10,11-hexahydro-4H,12H-azepino[3′,4′:4,5]pyrrolo[3,2,1-ij]quinolin-12-one
SMILES:
O=C1NCCCc2c1c1cccc3c1n2CCC3Molecular Processing
Molecular formula
C15H16N2O
Molecular weight
240.31
Exact mass
240.1263
XLogP
2.26
TPSA
34.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
18
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
70.91
Supplementary Information
Details werden geladen…
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