Name: 7,9-dimethyl-3,4-dihydro-1H-benzo[b]azepin-5(2H)-one hydrochloride
SMILES:
Cc1cc(C)c2c(c1)C(=O)CCCN2.ClMolecular Processing
Molecular formula
C12H16ClNO
Molecular weight
225.72
Exact mass
225.092
XLogP
3.11
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
2
Fraction Csp3
0.417
Molar refractivity
65.22
Supplementary Information
Details werden geladen…
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