Name: product
SMILES:
O=C1C(Cc2ccncc2)c2ccccc2N1N1CCCCC1Molecular Processing
Molecular formula
C19H21N3O
Molecular weight
307.4
Exact mass
307.1685
XLogP
3.16
TPSA
36.44
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.368
Molar refractivity
90.03
Supplementary Information
Details werden geladen…
An 8 Reaktionen beteiligt→