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Basic information
- CAS
5611-64-3- Standard SMILES
C=CCSCC1Nc2cc(Cl)c(S(N)(=O)=O)cc2S(=O)(=O)N1C- InChIKey
BDNLIZHZILNCGI-UHFFFAOYSA-N- Molecular formula
- C12H16ClN3O4S3
- Average molar mass
- 397.931 g/mol
- Monoisotopic mass
- 396.99914667
Names & identifiers
- Preferred name
- Methalthiazide
- English name
- Methalthiazide
- Molecular formula
- C12H16ClN3O4S3
- Molecular weight
- 397.92
Names & synonyms
P-2530Methalthiazide3-[(allylthio)methyl]-6-chloro-1,1-diketo-2-methyl-3,4-dihydrobenzo[e][1,2,4]thiadiazine-7-sulfonamide3-[(Allylthio)methyl]-6-chloro-3,4-dihydro-2-methyl-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide6-chloro-2-methyl-1,1-dioxo-3-(prop-2-enylsulfanylmethyl)-3,4-dihydrobenzo[e][1,2,4]thiadiazine-7-sulfonamide2H-1,2,4-Benzothiadiazine-7-sulfonamide, 6-chloro-3,4-dihydro-2-methyl-3-[(2-propen-1-ylthio)methyl]-, 1,1-dioxide
Database identifiers
- CAS
5611-64-3- PubChem CID
- 178131
- DTXSID
DTXSID001024013- ChEMBL
CHEMBL2106957- UNII
- 5N7ZBQ2KO9
Properties
Physicochemical properties
- Melting point
- 168.5 · 168.5-170 °C(Solv: isopropanol (67-63-0))
- Boiling point
- 617.2 · 617.2±65.0 °C(Predicted)
- Density
- 1.471 · 1.471±0.06 g/cm3(Predicted)
- pka
- 9.31 · 9.31±0.40(Predicted)
- FDA UNII
- 5 N7ZBQ2KO9 · 5N7ZBQ2KO9
Chemistry & industry
Applications
UsesDiuretic; antihypertensive.
Suppliers1 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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