Rationalizing the structural properties of bupivacaine base - a local anaesthetic - directly from powder diffraction data

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@article{cb5f7cd72594440f84bcbd5201201236,
title = "Rationalizing the structural properties of bupivacaine base - a local anaesthetic - directly from powder diffraction data",
abstract = "Bupivacaine belongs to a family of 1-alkyl-2',6'-pipecoloxylidides, which has shown promise as reversible action potential blockers that can introduce prolonged local anesthetic effects. The crystal structure of the free-base form of bupivacaine has been determined directly from powder X-ray diffraction data using the Genetic Algorithm technique for structure solution, followed by Rietveld refinement. This work further emphasizes the scope and utility of ab initio structure solution directly from powder X-ray diffraction data for tackling structural problems within the biomedical field, leading to opportunities for the investigation of structure-property relationships. (C) 2004 Wiley-Liss, Inc.",
keywords = "powder X-ray diffraction data, local anesthetic effects, bupivacaine base",
author = "Eugene Cheung and Kenneth Harris and Roy Johnston and Simon Kitchin and KL Hadden and M Zakrzewski",
year = "2004",
month = mar,
day = "1",
doi = "10.1002/jps.10551",
language = "English",
volume = "93",
pages = "667--674",
journal = "Journal of pharmaceutical sciences",
issn = "0022-3549",
publisher = "Wiley",

}

RIS

TY - JOUR

T1 - Rationalizing the structural properties of bupivacaine base - a local anaesthetic - directly from powder diffraction data

AU - Cheung, Eugene

AU - Harris, Kenneth

AU - Johnston, Roy

AU - Kitchin, Simon

AU - Hadden, KL

AU - Zakrzewski, M

PY - 2004/3/1

Y1 - 2004/3/1

N2 - Bupivacaine belongs to a family of 1-alkyl-2',6'-pipecoloxylidides, which has shown promise as reversible action potential blockers that can introduce prolonged local anesthetic effects. The crystal structure of the free-base form of bupivacaine has been determined directly from powder X-ray diffraction data using the Genetic Algorithm technique for structure solution, followed by Rietveld refinement. This work further emphasizes the scope and utility of ab initio structure solution directly from powder X-ray diffraction data for tackling structural problems within the biomedical field, leading to opportunities for the investigation of structure-property relationships. (C) 2004 Wiley-Liss, Inc.

AB - Bupivacaine belongs to a family of 1-alkyl-2',6'-pipecoloxylidides, which has shown promise as reversible action potential blockers that can introduce prolonged local anesthetic effects. The crystal structure of the free-base form of bupivacaine has been determined directly from powder X-ray diffraction data using the Genetic Algorithm technique for structure solution, followed by Rietveld refinement. This work further emphasizes the scope and utility of ab initio structure solution directly from powder X-ray diffraction data for tackling structural problems within the biomedical field, leading to opportunities for the investigation of structure-property relationships. (C) 2004 Wiley-Liss, Inc.

KW - powder X-ray diffraction data

KW - local anesthetic effects

KW - bupivacaine base

UR - http://www.scopus.com/inward/record.url?scp=1542515179&partnerID=8YFLogxK

U2 - 10.1002/jps.10551

DO - 10.1002/jps.10551

M3 - Article

C2 - 14762905

VL - 93

SP - 667

EP - 674

JO - Journal of pharmaceutical sciences

JF - Journal of pharmaceutical sciences

SN - 0022-3549

ER -