Name: (RS)-1-(4,4,7-trimethyl-1,4-dihydro-indeno[2,1-c]-pyrazol-1-yl)-propan-2-ol
SMILES:
CC1=C2C=c3c(cnn3CC(C)O)=C2C(C)(C)C=C1Molecular Processing
Molecular formula
C16H20N2O
Molecular weight
256.35
Exact mass
256.1576
XLogP
1.12
TPSA
38.05
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
76.65
Supplementary Information
Details werden geladen…
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