CC(Cn1ncc2c1=CC1=C(F)C=CC(C)(C)C=21)N=[N+]=[N-]
Name: (RS)-1-(2-azido-propyl)-7-fluoro-4,4-dimethyl-1,4-dihydro-indeno[2,1-c]pyrazole
SMILES: CC(Cn1ncc2c1=CC1=C(F)C=CC(C)(C)C=21)N=[N+]=[N-]

Molecular Processing

Molecular formula
C15H16FN5
Molecular weight
285.33
Exact mass
285.139
XLogP
2.35
TPSA
66.58
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
21
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
79.01

Supplementary Information

Details werden geladen…

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