الاسم: 1,1-dimethylethyl [4-({[(1S,2E)-4-(2,3-dihydro-1H-indol-1-yl)-1-(2-methylpropyl)-4-oxo-2-buten-1-yl]amino}carbonyl)tetrahydro-2H-pyran-4-yl]carbamate
SMILES:
CC(C)C[C@@H](/C=C/C(=O)N1CCc2ccccc21)NC(=O)C1(NC(=O)OC(C)(C)C)CCOCC1Molecular Processing
Molecular formula
C27H39N3O5
Molecular weight
485.63
Exact mass
485.289
XLogP
3.74
TPSA
96.97
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
35
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.593
Molar refractivity
135.18
Supplementary Information
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