4H-1-Benzopyran-4-one, 2,3-dihydro-8-(2-(diethylamino)ethyl)-5,7-dihydroxy-2-phenyl-, (S)-
Basic information
- CAS
183051-60-7- Standard SMILES
CCN(CC)CCc1c(O)cc(O)c2c1O[C@H](c1ccccc1)CC2=O- InChIKey
IUGHRWRPBJSPNC-IBGZPJMESA-N- Molecular formula
- C21H25NO4
- Average molar mass
- 355.4 g/mol
- Monoisotopic mass
- 355.17835828
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 2,3-dihydro-8-(2-(diethylamino)ethyl)-5,7-dihydroxy-2-phenyl-, (S)-
- IUPAC
- (2S)-8-[2-(diethylamino)ethyl]-5,7-dihydroxy-2-phenyl-2,3-dihydrochromen-4-one
- English name
- (2S)-8-(2-diethylaminoethyl)-5,7-dihydroxy-2-phenyl-chroman-4-one
- Molecular formula
- C21H25NO4
- Molecular weight
- 0
Names & synonyms
8-Diethylaminoethyl pinocembrin8-Diethylaminoethylpinocembrin4H-1-Benzopyran-4-one, 2,3-dihydro-8-(2-(diethylamino)ethyl)-5,7-dihydroxy-2-phenyl-, (S)-(S)-2,3-Dihydro-8-(2-(diethylamino)ethyl)-5,7-dihydroxy-2-phenyl-4H-1-benzopyran-4-oneDTXSID90171379RefChem:297224DTXCID7093870183051-60-7(2S)-8-[2-(diethylamino)ethyl]-5,7-dihydroxy-2-phenyl-2,3-dihydrochromen-4-one(S)-8-(2-(Diethylamino)ethyl)-5,7-dihydroxy-2-phenylchroman-4-one(2S)-8-[2-(diethylamino)ethyl]-5,7-dihydroxy-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one(2S)-8-[2-(Diethylamino)ethyl]-5,7-dihydroxy-2-phenyl-2,3-dihydro-4H-1-benzopyran-4-one
Show more names
(2S)-8-(2-diethylaminoethyl)-5,7-dihydroxy-2-phenyl-chroman-4-one
Database identifiers
- CAS
183051-60-7- PubChem CID
- 3075481
- DTXSID
DTXSID90171379
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 70 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 461
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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