Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]-
Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]-
CAS: 870544-59-5
Molecular Formula: C23H22F3N3O3
Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]- - Names and Identifiers
| Name | Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]- |
| Synonyms | BPTU CS-2758 BMS-646786 1-(2-(2-(tert-butyl)phenoxy)pyridin-3-yl)-3-(4-(trifluoromethoxy)phenyl)urea N-[2-[2-(1,1-Dimethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoromethoxy)phenyl]urea Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]- |
| CAS | 870544-59-5 |
Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]- - Physico-chemical Properties
| Molecular Formula | C23H22F3N3O3 |
| Molar Mass | 445.43 |
| Solubility | DMSO : ≥ 33.3 mg/mL (74.76 mM);H2O : < 0.1 mg/mL (insoluble) |
| Storage Condition | -20℃ |
| In vitro study | BPTU blocks the supramaximal fast inhibitory junction potentials (fIJP) in a concentration-dependent manner both in the rat and mouse colon. The EC 50 of BPTU is approximately 0.3 μM and 0.06 μM for the rat and mouse colon, respectively. In the rat colon, addition of the P2Y agonist ADPβS at 10 μM significantly reduces spontaneous contractions to a 43.2±13.4% (N=5) (P=0.0002), and this reduction is blocked by 15 min incubation with BPTU at a concentration of 3 μM (93.3±5.1%). Similar results are obtained in the murine colon where ADPβS at 10 μM reduces the area under the curve (AUC) of contractions to a 15.8±5.1% (N=4) (P<0.0001) and its effect is reversed with BPTU at 3 μM (82.7±3.6%). Addition of MRS2365, a selective P2Y1 agonist, at a concentration of 5 μM significantly reduces spontaneous contractions to a 21.2±4.8% (N=5) (P=0.0002) in the murine colon, and this reduction is blocked by 15 min incubation with BPTU at a concentration of 3 μM (93.1±3.8%). The blockage of the MRS2365-induced response by BPTU at 3 μM also occurs in control conditions (N=5) (10.2±5.5% vs. 86.7±5.0%). |
| In vivo study | Uptake of BPTU from the peritoneal cavity is relatively rapid. Blood boron levels are maximal within 1 h after administration. After only 1 h, a boron tumor-to-blood ratio above 1 is found for BPTU in pigmented tumors, which is indicative of drug retention. This is not seen in the non-pigmented tumor variant, in which tumor boron levels closely follow blood levels. Up to 24 h, Borocaptate sodium (BSH) exhibits no selective retention in either tumor, but achieves higher maximum tumor boron concentrations than BPTU as a result of the administration of higher amounts of boron. During the tissue distribution phase, liver-to-kidney boron concentration ratios range from 2 to 4 for BSH and from 0.5 to 1 for BPTU. |
Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]- - Preparation solution concentration reference
| 1mg | 5mg | 10mg | |
|---|---|---|---|
| 1 mM | 2.245 ml | 11.225 ml | 22.45 ml |
| 5 mM | 0.449 ml | 2.245 ml | 4.49 ml |
| 10 mM | 0.225 ml | 1.123 ml | 2.245 ml |
| 5 mM | 0.045 ml | 0.225 ml | 0.449 ml |
Last Update：2024-01-02 23:10:35
Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]- - Reference Information
| biological activity | BPTU (BMS-646786) is a non-nucleotide P2Y1 receptor allosteric antagonist with antithrombotic activity. BPTU is capable of blocking P2Y1 receptors located at the neuromuscular junction of the gastrointestinal tract. |
| Target | P2Y 1 |
Last Update：2024-04-10 22:29:15
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View History
Urea, N-[2-[2-(1,1-diMethylethyl)phenoxy]-3-pyridinyl]-N'-[4-(trifluoroMethoxy)phenyl]-
吡啶硫酮脲(PM)
Spiro[furo[3,4-c]pyridine-3(1H),4'-piperidin]-1-one hydrochloride
1-(2-METHYLPHENYL)-3-((3-(TRIFLUOROMETHYL)PHENYL)METHYL)UREA
Isopropyl 4-(4-formylpyrazol-1-yl)piperidine-1-carboxylate
ALUMINUM SILICATE
4-CYANOBENZENESULFONYL CHLORIDE 97
Phosphorothioic acid, O-(4-cyanophenyl) O-methyl ester
3-甲酰胺基丁酸
N-(4-氯-3-氰基-7-乙氧基喹啉-6-基)乙酰胺
吡啶硫酮脲(PM)
Spiro[furo[3,4-c]pyridine-3(1H),4'-piperidin]-1-one hydrochloride
1-(2-METHYLPHENYL)-3-((3-(TRIFLUOROMETHYL)PHENYL)METHYL)UREA
Isopropyl 4-(4-formylpyrazol-1-yl)piperidine-1-carboxylate
ALUMINUM SILICATE
4-CYANOBENZENESULFONYL CHLORIDE 97
Phosphorothioic acid, O-(4-cyanophenyl) O-methyl ester
3-甲酰胺基丁酸
N-(4-氯-3-氰基-7-乙氧基喹啉-6-基)乙酰胺