2-Thia-1,3,5-triaza-7-phosphaadamantane 2,2-dioxide
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Basic information
- Standard SMILES
O=S1(=O)N2CN3CN1CP(C3)C2- InChIKey
UGDYSCSSQAEHGD-UHFFFAOYSA-N- Molecular formula
- C5H10N3O2PS
- Average molar mass
- 207.19 g/mol
Names & identifiers
- Preferred name
- 2-Thia-1,3,5-triaza-7-phosphaadamantane 2,2-dioxide
- IUPAC
- 2λ6-thia-1,3,5-triaza-7-phosphatricyclo[3.3.1.13,7]decane 2,2-dioxide
Names & synonyms
SCHEMBL11586266UGDYSCSSQAEHGD-UHFFFAOYSA-N2-thia-1,3,5-triaza-7-phosphaadamantane 2,2-dioxide2-thia-1,3,5-triaza-7-phosphaadamantane-2,2-dioxide
Database identifiers
- PubChem CID
- 21829293
Properties
Computed structural propertiesFilling in
- XLogP
- -1
- Topological polar surface area
- 52.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 291
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Related reactions
5 records
Compound notes
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