Nom: 5-(2-methoxy-ethylamino)-1-methyl-1H-pyrazole-4-carboxylic acid adamantan-2-ylamide
SMILES:
COCCNc1c(C(=O)NC2C3CC4CC(C3)CC2C4)cnn1CMolecular Processing
Molecular formula
C18H28N4O2
Molecular weight
332.45
Exact mass
332.2212
XLogP
2.03
TPSA
68.18
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
24
Rings
5
Aromatic rings
1
Saturated rings
4
Aliphatic rings
4
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
91.87
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→