Basic information
- CAS
151606-30-3- Standard SMILES
CN(N=O)c1cc(O)ccc1O- InChIKey
HCJOLYFWJWJPTJ-UHFFFAOYSA-N- Molecular formula
- C7H8N2O3
- Average molar mass
- 168.15 g/mol
- Monoisotopic mass
- 168.05349212
Overview
Dephostatin is a member of hydroquinones.
Names & identifiers
- Preferred name
- Dephostatin
- IUPAC
- N-(2,5-dihydroxyphenyl)-N-methylnitrous amide
- English name
- DEPHOSTATIN
- Molecular formula
- C7H8N2O3
- Molecular weight
- 168.15
Names & synonyms
dephostatin151606-30-31,4-Benzenediol, 2-(methylnitrosoamino)-N-(2,5-dihydroxyphenyl)-N-methylnitrous amideRefChem:1320222-(Methylnitrosoamino)-1,4-benzenediolDTXSID30934304Lopac-D-8065Lopac0_000403CHEMBL269733orb3024278SCHEMBL3893046
Show more names
2-(methylnitrosoamino)-4-benzenediol2,5-DIHYDROXY-N-METHYL-N-NITROSOANILINE1,4-DIHYDROXY-N-METHYL-N-NITROSOANILINEDephostatin - CAS 151606-30-3 - Calbiochem1,4-Dihydroxy-N-methyl-N-nitrosoaniline, 2-(Methylnitrosoamino)-1,4-benzenediol, 2-(N-methyl-N-nitroso)hydroquinone
SCHEMBL12305062CHEBI:202847HMS3261A082-(N-methyl-N-nitroso)hydroquinoneTox21_500403HSCI1_000163HY-N15015AKOS006271953
Database identifiers
- CAS
151606-30-3- PubChem CID
- 2990
- DTXSID
DTXSID30934304
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 73.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 165
Physicochemical properties
- Boiling point
- 424.1 · 424.1±45.0 °C(Predicted)
- Density
- 1.36 · 1.36±0.1 g/cm3(Predicted)
- storage temp.
- 20 °C · −20°C
- solubility
- 22 mg/mL, · DMSO: 22 mg/mL, soluble
- form
- solid
- pka
- 9.23 · 9.23±0.43(Predicted)
- color
- light yellow
- WGK Germany
- 3 · 3
- RTECS
- 9021800 · CZ9021800
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- rtecs
- CZ9021800
Chemistry & industry
Applications
UsesDephostatin is a competitive protein tyrosine phosphatase (PTP) inhibitor that can be isolated from Streptomyces spp., with activity in the micromolar range[1].
Upstream & downstream products
Upstream raw materials
Suppliers3 total
TargetMol 中国（陶术生物）400-821-0310 15002144251 · [email protected]
山东领海生物科技有限公司15092083467 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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