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BM212 (Standard)

CAT: 0804-HY-100725RSize: 1 EachDry Ice: NoHazardous: No
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Description
BM212 (Standard) is the analytical standard of BM212. This product is intended for research and analytical applications. BM212 is a potent Mycobacterial membrane protein Large 3 (MmpL3) inhibitor. BM212 has strong bactericidal activity against both M. tuberculosis and some nontuberculosis mycobacteria. BM212 exhibits antimycobacterial activity against M. tuberculosis H37Rv with an MIC of 5 µM[1][2].
CAS Number
146204-42-4
UNSPSC
12352005
Target
Bacterial; Reference Standards
Related Pathways
Anti-infection; Others
Field of Research
Infection
Smiles
CN1CCN(CC2=C(C)N(C3=CC=C(Cl)C=C3)C(C4=CC=C(Cl)C=C4)=C2)CC1
Molecular Formula
C23H25Cl2N3
Molecular Weight
414.37
References & Citations
[1]Poce G et al. Improved BM212 MmpL3 inhibitor analogue shows efficacy in acute murine model of tuberculosis infection. PLoS One. 2013;8 (2) |[2]Deidda D et al. Bactericidal activities of the pyrrole derivative BM212 against multidrug-resistant and intramacrophagic Mycobacterium tuberculosis strains. Antimicrob Agents Chemother. 1998 Nov;42 (11) :3035-7.|[3]Albertus Viljoen, et al. Fast chemical force microscopy demonstrates that glycopeptidolipids define nanodomains of varying hydrophobicity on mycobacteria. Nanoscale Horiz. 2020 Jun 1;5 (6) :944-953.|[4]Delia Deidda, et al. Bactericidal activities of the pyrrole derivative BM212 against multidrug-resistant and intramacrophagic Mycobacterium tuberculosis strains. Antimicrob Agents Chemother. 1998 Nov;42 (11) :3035-7.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

BM-212

anti-mycobacterial agent; structure in first source

CAS Number146204-42-4
PubChem CID456926
IUPAC Name1-[[1,5-bis(4-chlorophenyl)-2-methylpyrrol-3-yl]methyl]-4-methylpiperazine
Molecular FormulaC23H25Cl2N3
Molecular Weight414.4
XLogP5.3
Topological Polar Surface Area11.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count28
Formal Charge0
Complexity480
SMILES
CC1=C(C=C(N1C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)CN4CCN(CC4)C
InChI
InChI=1S/C23H25Cl2N3/c1-17-19(16-27-13-11-26(2)12-14-27)15-23(18-3-5-20(24)6-4-18)28(17)22-9-7-21(25)8-10-22/h3-10,15H,11-14,16H2,1-2H3
InChIKey
YWZIODCWLMCMMW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of BM-212
CAS: 146204-42-4
CID: 456926
Formula: C23H25Cl2N3
MW: 414.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight414.4
XLogP35.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass413.1425532
Monoisotopic Mass413.1425532
Topological Polar Surface Area11.4 Ų
Heavy Atom Count28
Formal Charge0
Complexity480
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
MBS5752487BM212
A12124-50BM212 50mg
A12124-2BM212 2mg
A12124-1BM212 1mg
A12124-200BM212 200mg
A12124-100BM212 100mg
A12124-25BM212 25mg
A12124-10BM212 10mg
A12124-5BM212 5mg
abx098968-01Standard

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