الاسم: 5-Amino-2-cyclopentyl-4-(3-(dimethylamino)prop-1-ynyl)phenyl methyl carbonate
SMILES:
COC(=O)Oc1cc(N)c(C#CCN(C)C)cc1C1CCCC1Molecular Processing
Molecular formula
C18H24N2O3
Molecular weight
316.4
Exact mass
316.1787
XLogP
2.98
TPSA
64.79
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
90.53
Supplementary Information
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