Name: 2-{2-Chloro-5-[4-(pyrrolidine-1-carbonyl)-piperidin-1-yl]-phenyl}-5-methoxy-benzoimidazole-1-carboxylic acid tert-butyl ester
SMILES:
COc1ccc2c(c1)nc(-c1cc(N3CCC(C(=O)N4CCCC4)CC3)ccc1Cl)n2C(=O)OC(C)(C)CMolecular Processing
Molecular formula
C29H35ClN4O4
Molecular weight
539.08
Exact mass
538.2347
XLogP
5.99
TPSA
76.9
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
38
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.483
Molar refractivity
149.11
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→