Name: (2-{[(3,5-bis-trifluoromethyl-benzyl)-(2-methyl-2H-tetrazol-5-yl)-amino]-methyl}-4-trifluoromethyl-phenyl)-cyclopentyl-methanol
SMILES:
Cn1nnc(N(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)Cc2cc(C(F)(F)F)ccc2C(O)C2CCCC2)n1Molecular Processing
Molecular formula
C25H24F9N5O
Molecular weight
581.48
Exact mass
581.1837
XLogP
6.7
TPSA
67.07
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
40
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.48
Molar refractivity
123.49
Supplementary Information
Details werden geladen…
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