Name: (E)-2-chloro-11-(piperazin-1-yl)dibenzo[b,f][1,4]oxazepine
SMILES:
Clc1ccc2c(c1)C(N1CCNCC1)=Nc1ccccc1O2Molecular Processing
Molecular formula
C17H16ClN3O
Molecular weight
313.79
Exact mass
313.0982
XLogP
3.43
TPSA
36.86
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
22
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
88.61
Supplementary Information
Details werden geladen…
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