이름: (S)-6-{[(4-methoxybenzyl)(tetrahydropyran-4-ylmethyl)-amino]methyl}-1,2,3,4-tetrahydronaphthalen-2-ylamine
SMILES:
COc1ccc(CN(Cc2ccc3c(c2)CC[C@H](N)C3)CC2CCOCC2)cc1Molecular Processing
Molecular formula
C25H34N2O2
Molecular weight
394.56
Exact mass
394.262
XLogP
3.94
TPSA
47.72
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
29
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.52
Molar refractivity
117.09
Supplementary Information
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