Name: 5-(4-phenoxyphenyl)-7-(4-piperidyl)-7H-pyrrolo[2,3-d]pyrimidin-4-ylamine
SMILES:
Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)cn2C1CCNCC1Molecular Processing
Molecular formula
C23H23N5O
Molecular weight
385.47
Exact mass
385.1903
XLogP
4.4
TPSA
77.99
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
115.03
Supplementary Information
Details werden geladen…
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