Name: 6-[4-(3,3-Dimethyl-3-hydroxy-1-propynyl)phenyl]-(4-ethylpiperazin-1-yl)thieno[3,2-c]pyridine
SMILES:
CCN1CCN(c2cc3cnc(-c4ccc(C#CC(C)(C)O)cc4)cc3s2)CC1Molecular Processing
Molecular formula
C24H27N3OS
Molecular weight
405.57
Exact mass
405.1875
XLogP
4.23
TPSA
39.6
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
29
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
0.375
Molar refractivity
122.56
Supplementary Information
Details werden geladen…
An 1 Reaktionen beteiligt→