Name: (1R)-1′-({1-[4-(2-amino-1,3-thiazol-4-yl)phenyl]cyclopropyl}carbonyl)-3H-spiro[2-benzofuran-1,3′-pyrrolidin]-3-one
SMILES:
Nc1nc(-c2ccc(C3(C(=O)N4CC[C@@]5(C4)OC(=O)c4ccccc45)CC3)cc2)cs1Molecular Processing
Molecular formula
C24H21N3O3S
Molecular weight
431.52
Exact mass
431.1304
XLogP
3.72
TPSA
85.52
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
31
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.292
Molar refractivity
117.61
Supplementary Information
Details werden geladen…
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