N[C@@H]1CCCN2c3cc(Cl)ccc3Oc3ccccc3[C@H]12
Nom: trans-7-chloro-2,3,4,14b-tetrahydro-1H-dibenzo[b,f]pyrido[1,2-d][1,4]oxazepine-1-amine
SMILES: N[C@@H]1CCCN2c3cc(Cl)ccc3Oc3ccccc3[C@H]12

Molecular Processing

Molecular formula
C17H17ClN2O
Molecular weight
300.79
Exact mass
300.1029
XLogP
4.11
TPSA
38.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
21
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
85.26

Supplementary Information

No supplementary data available

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