CCN(CC)CCCNc1nn(CCC(C)N(C)C)c2ccc(Cl)cc12
Name: 1-(3-dimethylaminobutyl)-3-(3-diethylaminopropylamino)-5-chloroindazole
SMILES: CCN(CC)CCCNc1nn(CCC(C)N(C)C)c2ccc(Cl)cc12

Molecular Processing

Molecular formula
C20H34ClN5
Molecular weight
379.98
Exact mass
379.2503
XLogP
4.17
TPSA
36.33
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.65
Molar refractivity
113.4

Supplementary Information

Details werden geladen…

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