Name: trans-N-(7-chloro-2,3,4,14b-tetrahydro-1H-dibenzo[b,f]pyrido[1,2-d][1,4]oxazepin-1-yl)formamide
SMILES:
O=CN[C@@H]1CCCN2c3cc(Cl)ccc3Oc3ccccc3[C@H]12Molecular Processing
Molecular formula
C18H17ClN2O2
Molecular weight
328.8
Exact mass
328.0979
XLogP
3.9
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
23
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
90.28
Supplementary Information
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