Name: (4-chloro-2-{3-[3-(6-isopropyl-pyridin-3-yl)-phenyl]-3-oxo-propionylamino}-5-methyl-phenyl)-carbamic acid tert-butyl ester
SMILES:
Cc1cc(NC(=O)OC(C)(C)C)c(NC(=O)CC(=O)c2cccc(-c3ccc(C(C)C)nc3)c2)cc1ClMolecular Processing
Molecular formula
C29H32ClN3O4
Molecular weight
522.05
Exact mass
521.2081
XLogP
7.39
TPSA
97.39
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
37
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.31
Molar refractivity
147.38
Supplementary Information
Details werden geladen…
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