Basic information
- CAS
494833-80-6- Standard SMILES
NC(=O)Nc1cc(Br)sc1C(N)=O- InChIKey
DPTNHARZTUTCSK-UHFFFAOYSA-N- Molecular formula
- C6H6BrN3O2S
- Average molar mass
- 264.1 g/mol
- Monoisotopic mass
- 262.93640953
Names & identifiers
- Preferred name
- 5-Bromo-3-ureidothiophene-2-carboxamide
- IUPAC
- 5-bromo-3-(carbamoylamino)thiophene-2-carboxamide
Names & synonyms
5-Bromo-3-ureidothiophene-2-carboxamide494833-80-63-[(aminocarbonyl)amino]-5-bromothiophene-2-carboxamide5-bromo-3-(carbamoylamino)thiophene-2-carboxamideSCHEMBL490588DPTNHARZTUTCSK-UHFFFAOYSA-NDTXSID001204564DB-330984F51206(Aminocarbonyl)amino-5-bromothiophene-2-carboxamide3-[(Aminocarbonyl)amino]-5-bromo-2-thiophenecarboxamide3-[(Aminocarbonyl)amino]-5-bromothiophene-2 carboxamide
Database identifiers
- CAS
494833-80-6- PubChem CID
- 21975855
- DTXSID
DTXSID001204564
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 238
Related reactions
2 records
Compound notes
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