Название: 3,3-dimethyl-2-(3-methyl-5-morpholin-4-yl-phenyl)-1,2,3,4-tetrahydro-quinoline-6-carboxylic acid ethyl ester
SMILES:
CCOC(=O)c1ccc2c(c1)CC(C)(C)C(c1cc(C)cc(N3CCOCC3)c1)N2Molecular Processing
Molecular formula
C25H32N2O3
Molecular weight
408.54
Exact mass
408.2413
XLogP
4.74
TPSA
50.8
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.48
Molar refractivity
120.46
Supplementary Information
Загрузка подробностей…
Участвует в 6 реакциях→