Name: 1-[2-(2-Methoxyphenyl)-7-methylquinazolin-4-yl]-piperidin-4-ol
SMILES:
COc1ccccc1-c1nc(N2CCC(O)CC2)c2ccc(C)cc2n1Molecular Processing
Molecular formula
C21H23N3O2
Molecular weight
349.43
Exact mass
349.179
XLogP
3.57
TPSA
58.48
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
26
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
103.72
Supplementary Information
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