Basic information
- CAS
15686-78-9- Standard SMILES
O=C(Nc1ccc(Br)cc1)c1cc(Br)cc(Br)c1S- InChIKey
OKHDITLYENFQED-UHFFFAOYSA-N- Molecular formula
- C13H8Br3NOS
- Average molar mass
- 466 g/mol
- Monoisotopic mass
- 462.78767
Overview
Thiosalan is a small molecule drug. Thiosalan has a monoisotopic molecular weight of 462.79 Da.
Names & identifiers
- Preferred name
- Thiosalan
- IUPAC
- 3,5-dibromo-N-(4-bromophenyl)-2-sulfanylbenzamide
- English name
- 3,5-Dibromo-N-(4-bromophenyl)-2-mercaptobenzamide
- Molecular weight
- 0
Names & synonyms
THIOSALANTIOSALAN15686-78-93,5-dibromo-N-(4-bromophenyl)-2-sulfanylbenzamideThiosalan [USAN]Tiosalan [INN]18778VU19UBenzamide, 3,5-dibromo-N-(4-bromophenyl)-2-mercapto-3,4',5-Tribromo-2-mercaptobenzanilidethio-salanUNII-18778VU19U3,5-Dibromo-N-(4-bromophenyl)-2-mercaptobenzamide
Show more names
Thiosalan (USAN/INN)SCHEMBL2112176CHEMBL2107581DTXSID90166149NS00124085D06110Q27251978
Database identifiers
- CAS
15686-78-9- PubChem CID
- 27451
- DTXSID
DTXSID90166149- ChEMBL
CHEMBL2107581- UNII
- 18778VU19U
- Nikkaji
- J8.996F
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 30.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 323
Physicochemical properties
- FDA UNII
- 18778 VU19U · 18778VU19U
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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