Name: tert-butyl (2-(tetrahydro-2H-pyran-4-carboxamido)-4-(thiophen-2-yl)phenyl)carbamate
SMILES:
CC(C)(C)OC(=O)Nc1ccc(-c2cccs2)cc1NC(=O)C1CCOCC1Molecular Processing
Molecular formula
C21H26N2O4S
Molecular weight
402.52
Exact mass
402.1613
XLogP
5.13
TPSA
76.66
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
111.78
Supplementary Information
Details werden geladen…
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