Basic information
- CAS
7501-18-0- Standard SMILES
CCCCNC(=O)c1nsnc1NC(N)=O- InChIKey
IADZSJMFQQNWDQ-UHFFFAOYSA-N- Molecular formula
- C8H13N5O2S
- Average molar mass
- 243.29 g/mol
- Monoisotopic mass
- 243.07899585
Names & identifiers
- Preferred name
- N-butyl-4-(carbamoylamino)-1,2,5-thiadiazole-3-carboxamide
- IUPAC
- N-butyl-4-(carbamoylamino)-1,2,5-thiadiazole-3-carboxamide
Names & synonyms
7501-18-0N-butyl-4-(carbamoylamino)-1,2,5-thiadiazole-3-carboxamideNSC408086DTXSID70324967NSC-4080861,2,5-Thiadiazole, 3-(n-butylcarbamoyl)-4-ureido-
Database identifiers
- CAS
7501-18-0- PubChem CID
- 348653
- DTXSID
DTXSID70324967
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…