C=CCOC(=O)C(CCCC(N)C(=O)OCc1ccccc1Cl)NCC(N)C(=O)OC(C)(C)C
SMILES: C=CCOC(=O)C(CCCC(N)C(=O)OCc1ccccc1Cl)NCC(N)C(=O)OC(C)(C)C

Molecular Processing

Molecular formula
C24H36ClN3O6
Molecular weight
498.02
Exact mass
497.2293
XLogP
2.24
TPSA
142.97
H-bond donors
3
H-bond acceptors
9
Rotatable bonds
14
Heavy atoms
34
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.542
Molar refractivity
129.84

Supplementary Information

Details werden geladen…

An 2 Reaktionen beteiligt