Name: (±)-3,4-bis-cyclopropylmethoxy-N-[(3RS,4RS)-4-(3,4-dimethoxyphenyl)-7-oxabicyclo[4.1.0]-hept-3-yl]benzamide
SMILES:
COc1ccc(C2CC3OC3CC2NC(=O)c2ccc(OCC3CC3)c(OCC3CC3)c2)cc1OCMolecular Processing
Molecular formula
C29H35NO6
Molecular weight
493.6
Exact mass
493.2464
XLogP
4.72
TPSA
78.55
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
11
Heavy atoms
36
Rings
6
Aromatic rings
2
Saturated rings
4
Aliphatic rings
4
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.552
Molar refractivity
134.32
Supplementary Information
Details werden geladen…
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