Name: 2,4-diamino-6-ethyl-5-(4-chloro-3-decylcarbonylaminophenyl)pyrimidine
SMILES:
CCCCCCCCCCC(=O)Nc1cc(-c2c(N)nc(N)nc2CC)ccc1ClMolecular Processing
Molecular formula
C23H34ClN5O
Molecular weight
432.01
Exact mass
431.2452
XLogP
5.99
TPSA
106.92
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
12
Heavy atoms
30
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.522
Molar refractivity
126.54
Supplementary Information
Details werden geladen…
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