Abafungin structure, CAS 129639-79-8

Abafungin

CAS Number129639-79-8

SynonymsN-(4-(2-((2,4-Dimethylphenyl)oxy)phenyl)-1,3-thiazol-2-yl)-1,4,5,6-tetrahydro-2-pyrimidinamine; bay w 6341; Hexahydro-2-[[4-[o-(2,4-xylyloxy)phenyl]-2-thiazolyl]imino]pyrimidine; BAY-W 6341; N-[4-[2-(2,4-Dimethylphenoxy)phenyl]-2-thiazolyl]-1,4,5,6-tetrahydro-2-pyrimidinamine; N-[4-[2-(2,4-dimethylphenoxy)phenyl]-1,3-thiazol-2-yl]-1,4,5,6-tetrahydropyrimidin-2-amine; 4-[2-(2,4-Dimethylphenoxy)phenyl]-N-(tetrahydropyrimidin-2(1H)-ylidene)-1,3-thiazol-2-amine; Abafungin; N-{4-[2-(2,4-Dimethylphenoxy)phenyl]-1,3-thiazol-2-yl}-1,4,5,6-tetrahydro-2-pyrimidinamine

Molecular FormulaC21H22O1N4S1

Molecular Weight378.5

Purity98.00%

Density1.3±0.1 g/cm3

Boiling Point533.6±52.0 °C at 760 mmHg

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Cat. No.: 2A-9051980 Purity: 98.00%
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Quality Control of [ 129639-79-8 ] Purity: 98.00% SDS Specification MoL

Chemical & Physical Properties
CAS Number129639-79-8
Catalog No.2A-9051980
Chinese Name阿巴芬净
SynonymsN-(4-(2-((2,4-Dimethylphenyl)oxy)phenyl)-1,3-thiazol-2-yl)-1,4,5,6-tetrahydro-2-pyrimidinamine; bay w 6341; Hexahydro-2-[[4-[o-(2,4-xylyloxy)phenyl]-2-thiazolyl]imino]pyrimidine; BAY-W 6341; N-[4-[2-(2,4-Dimethylphenoxy)phenyl]-2-thiazolyl]-1,4,5,6-tetrahydro-2-pyrimidinamine; N-[4-[2-(2,4-dimethylphenoxy)phenyl]-1,3-thiazol-2-yl]-1,4,5,6-tetrahydropyrimidin-2-amine; 4-[2-(2,4-Dimethylphenoxy)phenyl]-N-(tetrahydropyrimidin-2(1H)-ylidene)-1,3-thiazol-2-amine; Abafungin; N-{4-[2-(2,4-Dimethylphenoxy)phenyl]-1,3-thiazol-2-yl}-1,4,5,6-tetrahydro-2-pyrimidinamine
Molecular FormulaC21H22O1N4S1
Molecular Weight378.5
Purity98.00
Density1.3±0.1 g/cm3
Boiling Point533.6±52.0 °C at 760 mmHg
Storage Condition2-8°C
ApplicationAbafungin is an antifungal agent that inhibits methyl transfer at the C-24 position of the sterol side chain, catalyzed by sterol-C-24-methyltransferase.
MDL NumberMFCD30478679
SMILESCc1ccc(Oc2ccccc2-c2csc(NC3=NCCCN3)n2)c(C)c1
InChIInChI=1S/C21H22N4OS/c1-14-8-9-18(15(2)12-14)26-19-7-4-3-6-16(19)17-13-27-21(24-17)25-20-22-10-5-11-23-20/h3-4,6-9,12-13H,5,10-11H2,1-2H3,(H2,22,23,24,25)
InChI KeyTYBHXIFFPVFXQW-UHFFFAOYSA-N
MSDSmsds/51980_1_129639_79_8.pdf
Transport InfoProduct Name: Abafungin
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