Name: N-[1-(3-cyclopentyl-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl)propyl]-2-ethylhexanamide
SMILES:
CCCCC(CC)C(=O)NC(CC)c1nnc(C2CCCC2)[nH]c1=OMolecular Processing
Molecular formula
C19H32N4O2
Molecular weight
348.49
Exact mass
348.2525
XLogP
3.61
TPSA
87.74
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
9
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.789
Molar refractivity
98.34
Supplementary Information
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Involved in 3 reactions→