Basic information
- CAS
27450-21-1- Standard SMILES
O=C(O)C(CCS(=O)c1ccccc1)C(=O)N(Nc1ccccc1)c1ccccc1- InChIKey
AMJPXGQNYYTBKB-UHFFFAOYSA-N- Molecular formula
- C23H22N2O4S
- Average molar mass
- 422.5 g/mol
- Monoisotopic mass
- 422.13002836
Names & identifiers
- Preferred name
- Osmadizone
- IUPAC
- 2-[anilino(phenyl)carbamoyl]-4-(benzenesulfinyl)butanoic acid
- English name
- Osmadizone
- Molecular formula
- C23H22N2O4S
- Molecular weight
- 422.5
Names & synonyms
OsmadizoneOsmadizona27450-21-1OsmadizonumPhensulfazideV3IN27OB0B(2-(Phenylsulfinyl)ethyl)malonic acid mono(1,2-diphenylhydrazide)RefChem:168671Osmadizone [INN]2-[anilino(phenyl)carbamoyl]-4-(benzenesulfinyl)butanoic acidOsmadizonum [INN-Latin]Osmadizona [INN-Spanish]
Show more names
2-(Phenylsulfinyl)ethyl-2-(1,2-diphenylhydrazinocarbonyl)acetic acidPropanedioic acid, 2-[2-(phenylsulfinyl)ethyl]-, 1-(1,2-diphenylhydrazide)
UNII-V3IN27OB0BSCHEMBL21096672-(2,3-Diphenylcarbazoyl)-4-phenylsulfinylbuttersaeureCHEMBL2105295DTXSID20865375NS00120138Q272914954-(Benzenesulfinyl)-2-(1,2-diphenylhydrazinecarbonyl)butanoic acid
Database identifiers
- CAS
27450-21-1- PubChem CID
- 65759
- DTXSID
DTXSID20865375- ChEMBL
CHEMBL2105295- UNII
- V3IN27OB0B
- Nikkaji
- J10.728J
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 582
Physicochemical properties
- Boiling point
- 656 · 656.0±65.0 °C(Predicted)
- Density
- 1.37 · 1.37±0.1 g/cm3(Predicted)
- pka
- -1.97 · -1.97±0.34(Predicted)
- FDA UNII
- 3 IN27OB0B · V3IN27OB0B
Chemistry & industry
Suppliers1 total
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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