Name: N-(5-(benzyloxy)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazol-6-yl)-N-(tetrahydro-2H-pyran-4-yl)acetamide
SMILES:
CC(=O)N(c1cc2c(cnn2C2CCCCO2)cc1OCc1ccccc1)C1CCOCC1Molecular Processing
Molecular formula
C26H31N3O4
Molecular weight
449.55
Exact mass
449.2315
XLogP
4.85
TPSA
65.82
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
126.35
Supplementary Information
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