Name: 6-{4-[Acetyl-(4-chloro-phenyl)-amino]-2-methyl-3,4-dihydro-2H-quinoline-1-carbonyl}-2,3-dihydro-benzo[1,4]oxazine-4-carboxylic acid ethyl ester
SMILES:
CCOC(=O)N1CCOc2ccc(C(=O)N3c4ccccc4C(N(C(C)=O)c4ccc(Cl)cc4)CC3C)cc21Molecular Processing
Molecular formula
C30H30ClN3O5
Molecular weight
548.04
Exact mass
547.1874
XLogP
6.23
TPSA
79.39
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
39
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
150.99
Supplementary Information
Details werden geladen…
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