Nom: 4-(8-(6-aminopyridin-3-yl)-1,4-dimethyl-4H-benzo[b][1,2,4]triazolo[4,3-d][1,4]diazepin-6(5H)-yl)benzamide
SMILES:
Cc1nnc2n1-c1ccc(-c3ccc(N)nc3)cc1N(c1ccc(C(N)=O)cc1)CC2CMolecular Processing
Molecular formula
C24H23N7O
Molecular weight
425.5
Exact mass
425.1964
XLogP
3.57
TPSA
115.95
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
32
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
124.12
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→