COC1=CC=CC(=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC
CAS: 109808-84-6
Name: 6,7-dimethoxy-1-[(3-methoxyphenyl)methyl]-1,2,3,4-tetrahydroisoquinoline
SMILES: COC1=CC=CC(=C1)CC2C3=CC(=C(C=C3CCN2)OC)OC

Molecular Processing

Molecular formula
C19H23NO3
Molecular weight
313.4
Exact mass
313.1678
XLogP
3.14
TPSA
39.72
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
90.69

Supplementary Information

InChIKey: NRJCAOCPBSXOGP-UHFFFAOYSA-N
Synonyme
6,7-dimethoxy-1-(3-methoxy-benzyl)-1,2,3,4-tetrahydro-isoquinoline109808-84-6SCHEMBL4026022NRJCAOCPBSXOGP-UHFFFAOYSA-NDB-3333011-(3-Methoxy-benzyl)-6,7-dimethoxy-1,2,3,4-tetrahydro-isoquinoline
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