COc1ccc(OC)c(CC2NCCc3c(OC)ccc(OC)c32)c1
CAS: 769172-78-3
Название: 1-[(2,5-dimethoxyphenyl)methyl]-5,8-dimethoxy-1,2,3,4-tetrahydroisoquinoline
SMILES: COc1ccc(OC)c(CC2NCCc3c(OC)ccc(OC)c32)c1

Molecular Processing

Molecular formula
C20H25NO4
Molecular weight
343.42
Exact mass
343.1784
XLogP
3.15
TPSA
48.95
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
97.24

Supplementary Information

InChIKey: SRKDGMYMABXBMA-UHFFFAOYSA-N
Синонимы
SCHEMBL4024298SRKDGMYMABXBMA-UHFFFAOYSA-N1-(2,5-dimethoxy-benzyl)-5,8-dimethoxy-1,2,3,4-tetrahydro-isoquinoline769172-78-3DB-3283741-(2,5-Dimethoxy-benzyl)-5,8-dimethoxy-1,2,3,4-tetrahydroisoquinoline
Источник →
Участвует в 8 реакциях→

Расширенный поиск

Поиск подструктуры→Поиск по сходству→