Basic information
- CAS
382180-17-8- Standard SMILES
O=C(CCCCCCC(=O)Nc1cccnc1)NO- InChIKey
PTJGLFIIZFVFJV-UHFFFAOYSA-N- Molecular formula
- C13H19N3O3
- Average molar mass
- 265.31 g/mol
- Monoisotopic mass
- 265.14264148
Overview
N'-hydroxy-N-(3-pyridinyl)octanediamide is an aromatic amide.
Names & identifiers
- Preferred name
- Pyroxamide
- IUPAC
- N'-hydroxy-N-pyridin-3-yloctanediamide
- English name
- Pyroxamide
- Molecular formula
- C13H19N3O3
- Molecular weight
- 265.31
Names & synonyms
pyroxamide382180-17-8n-hydroxy-n'-(pyridin-3-yl)octanediamideNSC696085suberoyl-3-aminopyridineamide hydroxamic acid12N86DSS23DTXSID70191595RefChem:177881DTXCID10114086N1-hydroxy-N8-(pyridin-3-yl)octanediamideN-Hydroxy-N'-3-pyridinyloctanediamideNSC-696085
Show more names
Pyroxamide PyroxaMide (NSC 696085)Pyroxamide, 10 mM in DMSOPyroxamide ISO 9001：2015 REACHN1-Hydroxy-N8-3-pyridinyl-octanediamideOctanediamide, N1-hydroxy-N8-3-pyridinyl-
N'-hydroxy-N-pyridin-3-yloctanediamideMFCD13194970NSC 696085Octanediamide, N-hydroxy-N'-3-pyridinyl-N-Hydroxy-N'-(3-pyridyl)-1,8-octanediamideN-Hydroxy-N'-3-pyridinyloctanediamid eOctanedioic acid hydroxyamide pyridin-3-ylamidePOLAR HYBRID COMPOUND
Database identifiers
- CAS
382180-17-8- PubChem CID
- 4996
- DTXSID
DTXSID70191595
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 91.3 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 284
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- storage temp.
- -20 °C · -20°C
- solubility
- 10 mg/mL · DMSO: soluble10mg/mL (clear solution)
- form
- powder
- color
- white to beige
- InChI
- 1S/C13H19N3O3/c17-12(15-11-6-5-9-14-10-11)7-3-1-2-4-8-13(18)16-19/h5-6,9-10,19H,1-4,7-8H2,(H,15,17)(H,16,18)
- InChIKey
- PTJGLFIIZFVFJV-UHFFFAOYSA-N
- SMILES
- ONC(=O)CCCCCCC(=O)Nc1cccnc1
- NCI Dictionary of Cancer Terms
- pyroxamide
- FDA UNII
- 12 N86DSS23 · 12N86DSS23
- NCI Drug Dictionary
- pyroxamide
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 77 · NA.77
- Symbol(GHS)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- 3
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Applications
DescriptionPyroxamide is an inhibitor of histone deacetylases (HDACs), including HDAC1 (IC50 = 0.1-0.2 μM). It induces growth suppression and cell death of certain types of cancer cells in culture.
UsesPyroxamide is an inhibitor of histone deacetylases (HDACs), including HDAC1 (IC50 = 0.1-0.2 μM). It induces growth suppression and cell death of certain types of cancer cells in culture.
UsesPyroamide is a histone decetylase inhibitor (HDCi), a novel class of anti-neoplastic agent that acts by enhancing acetylation of histones, promoting uncoiling of chromatin and activation of genes implicated in the regulation of cell survival such as poliferation, differentiation and apoptosis. Pyroamide is known to potently inhibits affinity purified HDAC1. Also inhibits the growth of tumor cells in vitro and in vivo. Induces p21/WAF1 expression in tumor cells.
Suppliers79 total
陕西缔都新材料有限公司81124267 17392282731 · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
上海微佳禾生物科技有限公司17502176150; 17502176150 · [email protected]
北京索莱宝科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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