N#Cc1ccc2c(c1)OCCC2NC(=O)CC(NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1
Name: N-(7-Cyano-chroman-4-yl)-3-(naphthalen-2-ylsulfonylamino)-3-phenyl-propionamide
SMILES: N#Cc1ccc2c(c1)OCCC2NC(=O)CC(NS(=O)(=O)c1ccc2ccccc2c1)c1ccccc1

Molecular Processing

Molecular formula
C29H25N3O4S
Molecular weight
511.6
Exact mass
511.1566
XLogP
4.76
TPSA
108.29
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
37
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.172
Molar refractivity
140.22

Supplementary Information

Details werden geladen…

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