Name: tert-butyl 2-(6-(methoxycarbonyl)-2-morpholino-4-oxo-4H-chromen-8-yl)-1H-pyrrole-1-carboxylate
SMILES:
COC(=O)c1cc(-c2cccn2C(=O)OC(C)(C)C)c2oc(N3CCOCC3)cc(=O)c2c1Molecular Processing
Molecular formula
C24H26N2O7
Molecular weight
454.48
Exact mass
454.174
XLogP
3.67
TPSA
100.21
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
33
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
121.91
Supplementary Information
Details werden geladen…
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