CN1CC(OC2=C(C1)C=CC(=N2)Cl)C3=CC=CC=C3
Name: (2R)-8-chloro-4-methyl-2-phenyl-3,5-dihydro-2H-pyrido[3,2-f][1,4]oxazepine
SMILES: CN1CC(OC2=C(C1)C=CC(=N2)Cl)C3=CC=CC=C3

Molecular Processing

Molecular formula
C15H15ClN2O
Molecular weight
274.75
Exact mass
274.0873
XLogP
3.3
TPSA
25.36
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.267
Molar refractivity
75.39

Supplementary Information

InChIKey: DZFSFMXDCYWTGN-ZDUSSCGKSA-N
Synonyms
SCHEMBL3703663DZFSFMXDCYWTGN-ZDUSSCGKSA-N(2R)-8-chloro-4-methyl-2-phenyl-3,5-dihydro-2H-pyrido[3,2-f][1,4]oxazepine(R)-8-chloro-4-methyl-2-phenyl-2,3,4,5-tetrahydropyrido[3,2-f][1,4]oxazepine
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Involved in 21 reactions→

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