7-Amino-6-ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
Basic information
- CAS
134894-56-7- Standard SMILES
CCN1C(=O)c2cccnc2Oc2cccc(N)c21- InChIKey
XODGFRIQTQJAFO-UHFFFAOYSA-N- Molecular formula
- C14H13N3O2
- Average molar mass
- 255.27 g/mol
- Monoisotopic mass
- 255.10077667
Names & identifiers
- Preferred name
- 7-Amino-6-ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one
- IUPAC
- 7-amino-6-ethylpyrido[2,3-b][1,5]benzoxazepin-5-one
Names & synonyms
7Am-6Et-PBOA-5one134894-56-77-Amino-6-ethyl-pyrido(2,3-b)(1,5)benzoxazepin-5(6H)-one7-Amino-6-ethyl-pyrido[2,3-b][1,5]benzoxazepin-5(6H)-oneCHEMBL301678SCHEMBL9098669DTXSID901590767-Amino-6-ethylpyrido[2,3-b][1,5]benzoxazepin-5(6H)-one7-amino-6-ethyl-pyrido[2,3-b][1,5]benzoxazepin-5-one
Database identifiers
- CAS
134894-56-7- PubChem CID
- 453972
- DTXSID
DTXSID90159076- ChEMBL
CHEMBL301678- Nikkaji
- J474.979K
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 68.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 350
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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