Name: 3-(4,7-dimethyl-3-oxo-2,3,4,10-tetrahydro-9-oxa-1,2,4a-triaza-phenanthren-6-yloxy)-3-methyl-azetidine-1-carboxylic acid tert-butyl ester
SMILES:
Cc1cc2c(cc1OC1(C)CN(C(=O)OC(C)(C)C)C1)N1C(=NNC(=O)C1C)CO2Molecular Processing
Molecular formula
C21H28N4O5
Molecular weight
416.48
Exact mass
416.206
XLogP
2.41
TPSA
92.7
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
2
Heavy atoms
30
Rings
4
Aromatic rings
1
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
111.03
Supplementary Information
Details werden geladen…
An 2 Reaktionen beteiligt→