الاسم: 1-(2-tert-butoxycarbonylamino-ethyl)-4-iodo-1H-pyrazole-3,5-dicarboxylic acid diethyl ester
SMILES:
CCOC(=O)c1nn(CCNC(=O)OC(C)(C)C)c(C(=O)OCC)c1IMolecular Processing
Molecular formula
C16H24IN3O6
Molecular weight
481.29
Exact mass
481.071
XLogP
2.37
TPSA
108.75
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
26
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.625
Molar refractivity
101.09
Supplementary Information
جارٍ جلب التفاصيل…
مشارك في 4 تفاعل→