Basic information
- CAS
77080-47-8- Standard SMILES
Cc1ccc(S(=O)(=O)NC(=O)c2cnc(N(C)C)s2)cc1- InChIKey
KXBUGGGHPSJFMP-UHFFFAOYSA-N- Molecular formula
- C13H15N3O3S2
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.0554837
Names & identifiers
- Preferred name
- 2-(Dimethylamino)-N-(4-methylbenzene-1-sulfonyl)-1,3-thiazole-5-carboxamide
- IUPAC
- 2-(dimethylamino)-N-(4-methylphenyl)sulfonyl-1,3-thiazole-5-carboxamide
Names & synonyms
77080-47-8DTXSID903201082-(Dimethylamino)-N-(4-methylbenzene-1-sulfonyl)-1,3-thiazole-5-carboxamideRefChem:253835DTXCID80271231NSC355137SCHEMBL8964858NSC-355137
Database identifiers
- CAS
77080-47-8- PubChem CID
- 337367
- DTXSID
DTXSID90320108
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 468
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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