Name: Intermediate 50
SMILES:
CC(C)(C)OC(=O)N1CC=C(c2ccc3oc(N)nc3c2)CC1Molecular Processing
Molecular formula
C17H21N3O3
Molecular weight
315.37
Exact mass
315.1583
XLogP
3.43
TPSA
81.59
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
88.82
Supplementary Information
Details werden geladen…
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