Basic information
- CAS
1094460-88-4- Standard SMILES
Cc1nc(-c2ccc(S(N)(=O)=O)cc2)cs1- InChIKey
UUHKWPQHPKMCCQ-UHFFFAOYSA-N- Molecular formula
- C10H10N2O2S2
- Average molar mass
- 254.3 g/mol
- Monoisotopic mass
- 254.01836991
Names & identifiers
- Preferred name
- 4-(2-Methyl-1,3-thiazol-4-yl)benzene-1-sulfonamide
- IUPAC
- 4-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamide
- English name
- 4-(2-Methyl-1,3-thiazol-4-yl)benzene-1-sulfonamide
- Molecular formula
- C10H10N2O2S2
- Molecular weight
- 254.33
Names & synonyms
1094460-88-44-(2-Methyl-1,3-thiazol-4-yl)benzene-1-sulfonamide4-(2-Methylthiazol-4-yl)benzenesulfonamideMFCD116507164-(2-methyl-1,3-thiazol-4-yl)benzenesulfonamideSCHEMBL18358985AKOS009386156AS-90354-(2-Methyl-4-thiazolyl)benzenesulfonamideDB-4114224-(2-Methyl-thiazol-4-yl)-benzenesulfonamideBenzenesulfonamide, 4-(2-methyl-4-thiazolyl)-
Show more names
EN300-272004G64709F518786
Database identifiers
- CAS
1094460-88-4- PubChem CID
- 43173625
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 331
Physicochemical properties
- Boiling point
- 461.6 · 461.6±47.0 °C(Predicted)
- Density
- 1.392 · 1.392±0.06 g/cm3(Predicted)
- pka
- 9.76 · 9.76±0.10(Predicted)
- HS Code
- 2934100090 · 2934100090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2934100090
Chemistry & industry
Suppliers5 total
台州南峰药物研究所[email protected] 13127117265 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
陕西爱施达尔生物科技有限公司18682931470; 18682931470 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
都创（上海）医药科技股份有限公司021-58099077-8041 18601625411 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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