Sulfazamet
Basic information
- CAS
852-19-7- Standard SMILES
Cc1cc(NS(=O)(=O)c2ccc(N)cc2)n(-c2ccccc2)n1- InChIKey
MTERSQYMYBGZTP-UHFFFAOYSA-N- Molecular formula
- C16H16N4O2S
- Average molar mass
- 328.4 g/mol
- Monoisotopic mass
- 328.09939694
Names & identifiers
- Preferred name
- Sulfazamet
- IUPAC
- 4-amino-N-(5-methyl-2-phenylpyrazol-3-yl)benzenesulfonamide
- English name
- sulfapyrazole
- Molecular formula
- C16H16N4O2S
- Molecular weight
- 328.39
Names & synonyms
SulfapyrazoleSULFAZAMET852-19-7SulfapirazolSulfapyrazolSulfazamet [USAN]SolfapirazoloSulfapyrazolumSulphapyrazoleSolfapirazolo [DCIT]Vesulong vet.Sulfapyrazole [INN]
Show more names
Sulfapyrazole solution,100ppm1-phenyl-3-methyl-5-sulfanilamidopyrazoleSulfapyrazole (Sulfazamet, Sulfamethylphenazole)N'-(3-Methyl-1-phenyl-1H-pyrazol-5-yl)sulfanilamide4-amino-N-(5-methyl-2-phenylpyrazol-3-yl)benzenesulfonamide4-amino-N-(5-methyl-2-phenyl-pyrazol-3-yl)benzenesulfonamide4-azanyl-N-(5-methyl-2-phenyl-pyrazol-3-yl)benzenesulfonamide4-Amino-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)benzenesulfonamide
Sulfapirazol [INN-Spanish]Sulfapyrazolum [INN-Latin]K980HZ9QO4SULFAZAMET [MI]EINECS 212-707-3Ba 18605DTXSID30234391Benzenesulfonamide, 4-amino-N-(3-methyl-1-phenyl-1H-pyrazol-5-yl)-
Database identifiers
- CAS
852-19-7- PubChem CID
- 13326
- DTXSID
DTXSID30234391- ChEMBL
CHEMBL2104908- UNII
- K980HZ9QO4
- EC Number
- 212-707-3
- Nikkaji
- J7.143I
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 98.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 479
Experimental & physicochemical properties
DrugsPharmaceuticals -> Antibiotics
Physicochemical properties
- Melting point
- 195 ° · 195° (Seydel, Krueger-Theimer); mp 181-182° (GB 848627)
- Boiling point
- 544.5 · 544.5±60.0 °C(Predicted)
- Density
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- pka
- 5.69 · 5.69(at 25℃)
- InChI
- InChI=1S/C16H16N4O2S/c1-12-11-16(20(18-12)14-5-3-2-4-6-14)19-23(21,22)15-9-7-13(17)8-10-15/h2-11,19H,17H2,1H3
- InChIKey
- MTERSQYMYBGZTP-UHFFFAOYSA-N
- SMILES
- C1(S(NC2N(C3=CC=CC=C3)N=C(C)C=2)(=O)=O)=CC=C(N)C=C1
- FDA UNII
- 980 HZ9QO4 · K980HZ9QO4
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Chemistry & industry
Pharmacology
ATC CodeQJ - Antiinfectives for systemic use
Applications
UsesAntibacterial.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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