이름: tert-butyl ((2S)-1-((2-(bis(4-methoxybenzyl)amino)-5-methyl-5H-chromeno[3,4-c]pyridin-8-yl)oxy)-4-methylpentan-2-yl)carbamate
SMILES:
COc1ccc(CN(Cc2ccc(OC)cc2)c2cc3c(cn2)C(C)Oc2cc(OC[C@H](CC(C)C)NC(=O)OC(C)(C)C)ccc2-3)cc1Molecular Processing
Molecular formula
C40H49N3O6
Molecular weight
667.85
Exact mass
667.3621
XLogP
8.74
TPSA
91.38
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
13
Heavy atoms
49
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
192.7
Supplementary Information
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