이름: methyl 4-{[{2-[(2-chlorobenzyl)-oxy]phenethyl}(5-methoxy-5-oxopentyl)amino]methyl}benzoate
SMILES:
COC(=O)CCCCN(CCc1ccccc1OCc1ccccc1Cl)Cc1ccc(C(=O)OC)cc1Molecular Processing
Molecular formula
C30H34ClNO5
Molecular weight
524.06
Exact mass
523.2126
XLogP
6.09
TPSA
65.07
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
14
Heavy atoms
37
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
144.86
Supplementary Information
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