Basic information
- CAS
5435-19-8- Standard SMILES
Cc1ccc(S(=O)(=O)NNC(=O)NNS(=O)(=O)c2ccc(C)cc2)cc1- InChIKey
VHDQWGMVEFANPD-UHFFFAOYSA-N- Molecular formula
- C15H18N4O5S2
- Average molar mass
- 398.5 g/mol
- Monoisotopic mass
- 398.07186168
Names & identifiers
- Preferred name
- 1,5-Bis(p-toluene sulfonyl) carbohydrazide
- IUPAC
- 1,3-bis[(4-methylphenyl)sulfonylamino]urea
Names & synonyms
5435-19-8NSC20231SCHEMBL11534302DTXSID40969440VHDQWGMVEFANPD-UHFFFAOYSA-NNSC-202311,5-bis(p-toluene sulfonyl) carbohydrazideDS-007064N,2-Bis(4-methylbenzene-1-sulfonyl)hydrazine-1-carbohydrazonic acidBenzenesulfonic acid,4-methyl-, 2-[[2-[(4-methylphenyl)sulfonyl]hydrazinyl]carbonyl]hydrazide
Database identifiers
- CAS
5435-19-8- PubChem CID
- 227979
- DTXSID
DTXSID40969440- Nikkaji
- J2.471.502G
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 610
Related reactions
1 records
Compound notes
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