Basic information
- CAS
438486-33-0- Standard SMILES
Clc1cc2c(c3ncccc13)OCN(C1CCCC1)C2- InChIKey
PJJRTPMSAXNYJE-UHFFFAOYSA-N- Molecular formula
- C16H17ClN2O
- Average molar mass
- 288.77 g/mol
- Monoisotopic mass
- 288.1029409
Names & identifiers
- Preferred name
- 6-chloro-3-cyclopentyl-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinoline
- IUPAC
- 6-chloro-3-cyclopentyl-2,4-dihydropyrido[3,2-h][1,3]benzoxazine
Names & synonyms
438486-33-06-chloro-3-cyclopentyl-3,4-dihydro-2H-[1,3]oxazino[5,6-h]quinolineIFLab1_004686Oprea1_859205Oprea1_871478CHEMBL4549627HMS1425E226-chloro-3-cyclopentyl-2,4-dihydropyrido[3,2-h][1,3]benzoxazineAKOS000807978CCG-309872IDI1_010441EU-0078764
Show more names
ST50037092SR-01000496985SR-01000496985-1Z57213563F1094-01666-chloro-3-cyclopentyl-2H,4H-1,3-oxazino[5,6-h]quinoline
Database identifiers
- CAS
438486-33-0- PubChem CID
- 696602
- ChEMBL
CHEMBL4549627- EC Number
- 189-915-5
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 25.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 347
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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