Nitrosulfathiazole
Basic information
- CAS
473-42-7- Standard SMILES
O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nccs2)cc1- InChIKey
CIASIHHEOGXVOM-UHFFFAOYSA-N- Molecular formula
- C9H7N3O4S2
- Average molar mass
- 285.3 g/mol
- Monoisotopic mass
- 284.98779806
Overview
Nitrosulfathiazole is a small molecule drug. Nitrosulfathiazole has a monoisotopic molecular weight of 284.99 Da.
Names & identifiers
- Preferred name
- Nitrosulfathiazole
- IUPAC
- 4-nitro-N-(1,3-thiazol-2-yl)benzenesulfonamide
- English name
- Nitrosulfathiazole
- Molecular formula
- C9H7N3O4S2
- Molecular weight
- 285.3
Names & synonyms
Nitrosulfathiazole473-42-7para-NitrosulfathiazoleNitrosulfatiazolNisulfazolNitrosulfathiazolSulfanitrothiazoleNitrosulfathiazolumNitrosulfathiazole [INN]UNII-FO9CU4TX7JFO9CU4TX7JPara-nitrosulfathiazole [NF]
Show more names
Nisulfazolep-Nitrosulfathiazolep-Nitrosulphathiazole4-Nitro-N-(2-thiazolyl)benzenesulfonamide4-nitro-N-thiazol-2-yl-benzenesulfonamide4-nitro-N-(1,3-thiazol-2-yl)benzenesulfonamide
2-(p-Nitrophenylsulfonamido)thiazolep-Nitro-N-2-thiazolylbenzenesulfonamide4-Nitro-N-(2-thiazolyl)benzolsulfonamidDTXSID10197091Benzenesulfonamide, 4-nitro-N-2-thiazolyl-Benzenesulfonamide, p-nitro-N-2-thiazolyl-RefChem:166144DTXCID20119582
Database identifiers
- CAS
473-42-7- PubChem CID
- 10127
- DTXSID
DTXSID10197091- ChEMBL
CHEMBL593262- UNII
- FO9CU4TX7J
- Nikkaji
- J10.630E
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 142 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 395
Experimental & physicochemical properties
LogP1.19
Physicochemical properties
- Melting point
- 270 °C · 270 °C(Solv: acetone (67-64-1))
- Boiling point
- 495 · 495.0±47.0 °C(Predicted)
- Density
- 1.648 · 1.648±0.06 g/cm3(Predicted)
- pka
- 5.78 · 5.78±0.10(Predicted)
- FDA UNII
- 9 CU4TX7J · FO9CU4TX7J
Chemistry & industry
Applications
UsesMedicine (antibacterial).
Upstream & downstream products
Downstream products
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…