Nombre: 1-(3-acetylthiopropanoyl)-indoline-2-carboxylic acid methyl ester
SMILES:
COC(=O)C1Cc2ccccc2N1C(=O)CCSC(C)=OMolecular Processing
Molecular formula
C15H17NO4S
Molecular weight
307.37
Exact mass
307.0878
XLogP
1.79
TPSA
63.68
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
81.19
Supplementary Information
Obteniendo detalles…
Participa en 3 reacciones→