C=CCOC(=O)C1CSCC(NC(=O)OC(C)(C)C)C1=O
SMILES: C=CCOC(=O)C1CSCC(NC(=O)OC(C)(C)C)C1=O

Molecular Processing

Molecular formula
C14H21NO5S
Molecular weight
315.39
Exact mass
315.114
XLogP
1.54
TPSA
81.7
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
21
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.643
Molar refractivity
80.14

Supplementary Information

Details werden geladen…

An 4 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→