Name | m-aminobenzamide |
Synonyms | 3-ABA INO1001 INO 1001 3544-24-9 3-aminobenzamide m-aminobenzamide 3-AMINOBENZAMIDE M-AMINOBENZAMIDE Benzamide, 3-amino- PARP Inhibitor I, 3-ABA INO-1001(3-Aminobenzamide |
CAS | 3544-24-9 |
EINECS | 222-586-9 |
InChI | InChI=1/C7H8N2O/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H2,9,10) |
Molecular Formula | C7H8N2O |
Molar Mass | 136.15 |
Density | 1.1778 (rough estimate) |
Melting Point | 115-116 °C (lit.) |
Boling Point | 250.42°C (rough estimate) |
Flash Point | 153.2°C |
Water Solubility | Soluble in dimethylformamide (~30 mg/ml), dimethyl sulfoxide (~30 mg/ml), phosphate buffered saline (pH7.2) (~2 mg/ml), water (25 mg/ml), and ethanol (25 mg/ml). |
Solubility | ethanol: 50mg/mL, clear, faintly yellow |
Vapor Presure | 0.000175mmHg at 25°C |
Appearance | powder |
Color | white to off-white |
BRN | 2802373 |
pKa | 16.26±0.50(Predicted) |
Storage Condition | room temp |
Stability | Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20°C for up to 1 month. |
Sensitive | Light Sensitive |
Refractive Index | 1.5769 (estimate) |
MDL | MFCD00007989 |
Physical and Chemical Properties | White powder, melting point 115-117 °c. |
In vitro study | 3-Aminobenzamide (PARP-IN-1) (>1 μM) causes more than 95% inhibition of PARP activity without significant cellular toxicity. INO-1001 significantly sensitizes CHO cells by blocking most of the DNA repair occurring between radiation fractions.3-Aminobenzamide significantly improves endothelial function by enhancing the acetylcholine-induced, endothelium-dependent, nitric oxide mediated vasorelaxation after exposure with 400 μM H 2 O 2 . |
In vivo study | In a db/db (Lepr db/db ) mouse model, 3-Aminobenzamide ameliorates diabetes-induced albumin excretion and mesangial expansion, and also decreases diabetes-induced podocyte depletion. 3-Aminobenzamide (1.6 mg/kg via intracerebral injection) prevents NAD + depletion and improves water maze performance after controlled cortical impact (CCI) in mice. |
Hazard Symbols | Xi - Irritant |
Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. S37/39 - Wear suitable gloves and eye/face protection |
UN IDs | 3077 |
WGK Germany | 3 |
RTECS | CU8992000 |
HS Code | 29242990 |
NIST chemical information | Information provided by: webbook.nist.gov (external link) |
biological activity | 3-Aminobenzamide (3-ABA , 3-Amino Benzamide, 3-AB) is an effective Poly(ADP-ribose)polymerase (PARP) inhibitors can also inhibit apoptosis after SCI spinal cord injury in a caspase-independent manner. |
Target | Value |
use | organic chemical raw material intermediates. |
category | toxic substances |
toxicity classification | poisoning |
acute toxicity | oral-wild bird LD50: 1000 mg/kg |
flammability hazard characteristics | combustible; combustion produces toxic nitrogen oxide smoke |
storage and transportation characteristics | warehouse ventilation and low temperature drying |
fire extinguishing agent | dry powder, foam, sand, carbon dioxide, mist water |
toxic substance data | information provided by: pubchem.ncbi.nlm.nih.gov (external link) |