名称: 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]pyrrolidin-3-amine
SMILES:
C1CN(CC1N)CCCOCCC2=CC3=C(C=C2)SC=C3Molecular Processing
Molecular formula
C17H24N2OS
Molecular weight
304.46
Exact mass
304.1609
XLogP
2.88
TPSA
38.49
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
90
Supplementary Information
InChIKey: RMSPWVGIOSSPPJ-UHFFFAOYSA-N
同義語
SCHEMBL47944RMSPWVGIOSSPPJ-UHFFFAOYSA-N1-(3-(2-(1-benzothiophene-5-yl)ethoxy)propyl)-3-pyrrolidinamine1-{3-[2-(1-benzothiophen-5-yl)ethoxy]propyl}-3-pyrrolidinamine
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