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Key Documents

542091

Sigma-Aldrich

(S)-(-)-1-Boc-2-吡咯烷甲腈

97%

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About This Item

經驗公式(希爾表示法):
C10H16N2O2
CAS號碼:
分子量::
196.25
MDL號碼:
分類程式碼代碼:
12352005
PubChem物質ID:
NACRES:
NA.22

化驗

97%

光學活性

[α]20/D −105.5°, c = 1 in chloroform

mp

33-36 °C (lit.)

SMILES 字串

CC(C)(C)OC(=O)N1CCC[C@H]1C#N

InChI

1S/C10H16N2O2/c1-10(2,3)14-9(13)12-6-4-5-8(12)7-11/h8H,4-6H2,1-3H3/t8-/m0/s1

InChI 密鑰

MDMSZBHMBCNYNO-QMMMGPOBSA-N

應用

用于合成脯氨酰寡肽酶抑制剂。

儲存類別代碼

10 - Combustible liquids

水污染物質分類(WGK)

WGK 3

閃點(°F)

230.0 °F - closed cup

閃點(°C)

110 °C - closed cup

個人防護裝備

Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)


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分析證明 (COA)

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Janice Lawandi et al.
Journal of medicinal chemistry, 52(21), 6672-6684 (2009-11-06)
Prolyl oligopeptidases cleave peptides on the carboxy side of internal proline residues and their inhibition has potential in the treatment of human brain disorders. Using our docking program fitted, we have designed a series of constrained covalent inhibitors, built from
Erik A A Wallén et al.
Journal of medicinal chemistry, 46(21), 4543-4551 (2003-10-03)
Isophthalic acid bis(l-prolyl-pyrrolidine) amide is a very potent prolyl oligopeptidase inhibitor, but it has a log P value of -0.2, which is very low for a compound targeted to the brain. Therefore, these types of compounds were further modified to

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