CCOc1ccc(Cl)cc1-c1cc(Nc2ccc(CO)cc2)nc(N)n1
CAS: 710335-06-1
Name: [4-[[2-amino-6-(5-chloro-2-ethoxyphenyl)pyrimidin-4-yl]amino]phenyl]methanol
SMILES: CCOc1ccc(Cl)cc1-c1cc(Nc2ccc(CO)cc2)nc(N)n1

Molecular Processing

Molecular formula
C19H19ClN4O2
Molecular weight
370.84
Exact mass
370.1197
XLogP
4.01
TPSA
93.29
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
103.71

Supplementary Information

InChIKey: JLWLMNIZKVKADB-UHFFFAOYSA-N
Synonyme
CT-32615UNII-3SI12BK34I3SI12BK34IBenzenemethanol, 4-((2-amino-6-(5-chloro-2-ethoxyphenyl)-4-pyrimidinyl)amino)-CHEMBL75522710335-06-1{4-[2-Amino-6-(5-chloro-2-ethoxy-phenyl)-pyrimidin-4-ylamino]-phenyl}-methanolSCHEMBL4282797JLWLMNIZKVKADB-UHFFFAOYSA-NBDBM50144722Q27257983
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