Boc-D-Prolinol

CAS# 83435-58-9

Boc-D-Prolinol

2D Structure

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3D structure

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Boc-D-Prolinol

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Chemical Properties of Boc-D-Prolinol

Cas No. 83435-58-9 SDF Download SDF
PubChem ID 688279 Appearance Powder
Formula C10H19NO3 M.Wt 201.3
Type of Compound N/A Storage Desiccate at -20°C
Solubility Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
Chemical Name tert-butyl (2R)-2-(hydroxymethyl)pyrrolidine-1-carboxylate
SMILES CC(C)(C)OC(=O)N1CCCC1CO
Standard InChIKey BFFLLBPMZCIGRM-MRVPVSSYSA-N
Standard InChI InChI=1S/C10H19NO3/c1-10(2,3)14-9(13)11-6-4-5-8(11)7-12/h8,12H,4-7H2,1-3H3/t8-/m1/s1
General tips For obtaining a higher solubility , please warm the tube at 37 ℃ and shake it in the ultrasonic bath for a while.Stock solution can be stored below -20℃ for several months.
We recommend that you prepare and use the solution on the same day. However, if the test schedule requires, the stock solutions can be prepared in advance, and the stock solution must be sealed and stored below -20℃. In general, the stock solution can be kept for several months.
Before use, we recommend that you leave the vial at room temperature for at least an hour before opening it.
About Packaging 1. The packaging of the product may be reversed during transportation, cause the high purity compounds to adhere to the neck or cap of the vial.Take the vail out of its packaging and shake gently until the compounds fall to the bottom of the vial.
2. For liquid products, please centrifuge at 500xg to gather the liquid to the bottom of the vial.
3. Try to avoid loss or contamination during the experiment.
Shipping Condition Packaging according to customer requirements(5mg, 10mg, 20mg and more). Ship via FedEx, DHL, UPS, EMS or other couriers with RT, or blue ice upon request.

Boc-D-Prolinol Dilution Calculator

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Boc-D-Prolinol Molarity Calculator

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Preparing Stock Solutions of Boc-D-Prolinol

1 mg 5 mg 10 mg 20 mg 25 mg
1 mM 4.9677 mL 24.8385 mL 49.6771 mL 99.3542 mL 124.1927 mL
5 mM 0.9935 mL 4.9677 mL 9.9354 mL 19.8708 mL 24.8385 mL
10 mM 0.4968 mL 2.4839 mL 4.9677 mL 9.9354 mL 12.4193 mL
50 mM 0.0994 mL 0.4968 mL 0.9935 mL 1.9871 mL 2.4839 mL
100 mM 0.0497 mL 0.2484 mL 0.4968 mL 0.9935 mL 1.2419 mL
* Note: If you are in the process of experiment, it's necessary to make the dilution ratios of the samples. The dilution data above is only for reference. Normally, it's can get a better solubility within lower of Concentrations.

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References on Boc-D-Prolinol

Synthesis and pharmacological investigation of azaphthalazinone human histamine H(1) receptor antagonists.[Pubmed:22985961]

Bioorg Med Chem. 2012 Oct 15;20(20):6097-108.

5-Aza, 6-aza, 7-aza and 8-aza-phthalazinone, and 5,8-diazaphthalazinone templates were synthesised by stereoselective routes starting from the appropriate pyridine/pyrazine dicarboxylic acids by activation with CDI, reaction with 4-chlorophenyl acetate ester enolate to give a beta-ketoester, which was hydrolysed, and decarboxylated. The resulting ketone was condensed with hydrazine to form the azaphthalazinone core. The azaphthalazinone cores were alkylated with N-Boc-D-Prolinol at N-2 by Mitsunobu reaction, de-protected, and then alkylated at the pyrrolidine nitrogen to provide the target H(1) receptor antagonists. All four mono-azaphthalazinone series had higher affinity (pK(i)) for the human H(1) receptor than azelastine, but were not as potent as the parent non-aza phthalazinone. The 5,8-diazaphthalazinone was equipotent with azelastine. The least potent series were the 7-azaphthalazinones, whereas the 5-azaphthalazinones were the most lipophilic. The more hydrophilic series were the 8-aza series. Replacement of the N-methyl substituent on the pyrrolidine with the n-butyl group caused an increase in potency (pA(2)) and a corresponding increase in lipophilicity. Introduction of a beta-ether oxygen in the n-butyl analogues (2-methoxyethyl group) decreased the H(1) pA(2) slightly, and increased the selectivity against hERG. The duration of action in vitro was longer in the 6-azaphthalazinone series. The more potent and selective 6-azaphthalazinone core was used to append an H(3) receptor antagonist fragment, and to convert the series into the long acting single-ligand, dual H(1) H(3) receptor antagonist 44. The pharmacological profile of 44 was very similar to our intranasal clinical candidate 1.

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