Methanone, (3-((1,1-dioxido-2-isothiazolidinyl)methyl)-5-(phenylmethyl)phenyl)(8-hydroxy-1,6-naphthyridin-7-yl)-
Basic information
- CAS
422550-94-5- Standard SMILES
O=C(c1cc(Cc2ccccc2)cc(CN2CCCS2(=O)=O)c1)c1ncc2cccnc2c1O- InChIKey
UMPCIKHDGHZMJR-UHFFFAOYSA-N- Molecular formula
- C26H23N3O4S
- Average molar mass
- 473.5 g/mol
- Monoisotopic mass
- 473.1409274
Names & identifiers
- Preferred name
- Methanone, (3-((1,1-dioxido-2-isothiazolidinyl)methyl)-5-(phenylmethyl)phenyl)(8-hydroxy-1,6-naphthyridin-7-yl)-
- IUPAC
- [3-benzyl-5-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]phenyl]-(8-hydroxy-1,6-naphthyridin-7-yl)methanone
Names & synonyms
1,6-Naphthyridine A422550-94-5Methanone, (3-((1,1-dioxido-2-isothiazolidinyl)methyl)-5-(phenylmethyl)phenyl)(8-hydroxy-1,6-naphthyridin-7-yl)-DTXSID80195089Methanone, [3-[(1,1-dioxido-2-isothiazolidinyl)methyl]-5-(phenylmethyl)phenyl](8-hydroxy-1,6-naphthyridin-7-yl)-RefChem:352631DTXCID40117580CHEMBL32865[3-benzyl-5-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]phenyl]-(8-hydroxy-1,6-naphthyridin-7-yl)methanoneSCHEMBL6480278BDBM50123468[3-Benzyl-5-(1,1-dioxo-1lambda 6 -isothiazolidin-2-ylmethyl)-phenyl]-(8-hydroxy-[1,6]naphthyridin-7-yl)-methanone
Show more names
[3-Benzyl-5-(1,1-dioxo-1lambda*6*-isothiazolidin-2-ylmethyl)-phenyl]-(8-hydroxy-[1,6]naphthyridin-7-yl)-methanone[3-benzyl-5-(1,1-dioxo-1lambda-6-isothiazolidin-2-ylmethyl)-phenyl]-(8-hydroxy-[1,6]naphthyridin-7-yl)-methanone2-{[3-Benzyl-5-(8-hydroxy-1,6-naphthyridine-7-carbonyl)phenyl]methyl}-1lambda~6~,2-thiazolidine-1,1-dione
Database identifiers
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 109 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 809
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Compound notes
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