Basic information
- CAS
58671-21-9- Standard SMILES
c1ccc(CN2COc3ccc4c5c(ccc4c3C2)OCN(Cc2ccccc2)C5)cc1- InChIKey
ZQMYHQFLCMONLU-UHFFFAOYSA-N- Molecular formula
- C28H26N2O2
- Average molar mass
- 422.5 g/mol
- Monoisotopic mass
- 422.19942808
Names & identifiers
- Preferred name
- 1,3-Oxazino(5',6':5,6)naphth(1,2-e)(1,3)oxazine, 2,3,4,8,9,10-hexahydro-3,9-bis(phenylmethyl)-
- IUPAC
- 3,9-dibenzyl-2,4,8,10-tetrahydro-[1,3]benzoxazino[6,5-f][1,3]benzoxazine
Names & synonyms
58671-21-91,3-Oxazino(5',6':5,6)naphth(1,2-e)(1,3)oxazine, 2,3,4,8,9,10-hexahydro-3,9-bis(phenylmethyl)-7I0QE1VX3PNSC88844NSC 88844UNII-7I0QE1VX3PNSC-888442,3,4,8,9,10-Hexahydro-3,9-bis(phenylmethyl)-1,3-oxazino(5',6':5,6)naphth(1,2-E)(1,3)oxazine1,3-Oxazino[5',6':5,6]naphth[1,2-e][1,3]oxazine, 2,3,4,8,9,10-hexahydro-3,9-bis(phenylmethyl)-3,9-dibenzyl-2,4,8,10-tetrahydro-[1,3]benzoxazino[6,5-f][1,3]benzoxazineDTXSID802073733,9-Dibenzyl-2,3,4,8,9,10-hexahydronaphtho[1,2-e:5,6-e']bis[1,3]oxazine
Show more names
NAPHTHO(1,2-E:5,6-E')BIS(1,3)OXAZINE, 2,3,4,8,9,10-HEXAHYDRO-3,9-BIS(PHENYLMETHYL)-
Database identifiers
- CAS
58671-21-9- PubChem CID
- 259169
- DTXSID
DTXSID80207373- UNII
- 7I0QE1VX3P
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 550
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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