Pentamidine dihydrochloride

CAT: 0931-T23132-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No

1 / 1

CAT#:0931-T23132-01Size:1 mL - 10 mM (in DMSO)

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

50357-45-4

Target

Antibiotic, Antibacterial, Antifungal, Parasite, Phosphatase

Related Pathways

Microbiology/Virology, Metabolism

Purity

0.998

Bioactivity

Pentamidine dihydrochloride (MP-601205 dihydrochloride) is an aromatic diamidine agent effective against various microorganisms, including protozoa (Trypanosoma brucei, Leishmania spp., and Babesia spp.) and fungi (Pneumocystis jirovecii) . It is a potent and selective inhibitor of protein tyrosine phosphatases and phosphatase of regenerating liver. Pentamidine dihydrochloride inhibits the parasite Leishmania infantum with an IC50 of 2.5 μM.

Smiles

NC(c(cc1)ccc1OCCCCCOc(cc1)ccc1C(N)=N)=N.Cl.Cl

Molecular Formula

C19H26Cl2N4O2

Molecular Weight

413.34

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Pentamidine dihydrochloride

CAS Number	50357-45-4
PubChem CID	10431865
IUPAC Name	4-[5-(4-carbamimidoylphenoxy)pentoxy]benzenecarboximidamide;dihydrochloride
Molecular Formula	C19H26Cl2N4O2
Molecular Weight	413.3
Topological Polar Surface Area	118
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	10
Heavy Atom Count	27
Formal Charge	0
Complexity	376

SMILES

C1=CC(=CC=C1C(=N)N)OCCCCCOC2=CC=C(C=C2)C(=N)N.Cl.Cl

InChI

InChI=1S/C19H24N4O2.2ClH/c20-18(21)14-4-8-16(9-5-14)24-12-2-1-3-13-25-17-10-6-15(7-11-17)19(22)23;;/h4-11H,1-3,12-13H2,(H3,20,21)(H3,22,23);2*1H

InChIKey

HWURPQUPKQFGJI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 50357-45-4

CID: 10431865

Formula: C19H26Cl2N4O2

MW: 413.3

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	413.3
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	10
Exact Mass	412.1432815
Monoisotopic Mass	412.1432815
Topological Polar Surface Area	118 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	376
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

Related Products

Catalog	Name
T23133-01	Pentamidine
T28355-01	Pentamidine dimesylate
T1654-01	Pentamidine isethionate
T20109-01	Cystamine dihydrochloride
T23122	PB28 dihydrochloride
T39194	PLX647 dihydrochloride
T22802-01	GNTI dihydrochloride
T23177	PPACK Dihydrochloride
T68652-01	Carmegliptin dihydrochloride
T212318-01	Tuspetinib dihydrochloride

Alternative Products

Catalog	Name
BUP13318-01	Pentamidine dihydrochloride
HY-B0537A	Pentamidine (dihydrochloride)
HY-B0537AS-01	Pentamidine-d4 (dihydrochloride)
A8498-50	Pentamidine
HY-B0537C	Pentamidine (dimesylate)
HY-B0537R-01	Pentamidine (Standard)

Pentamidine dihydrochloride

Chemical Information

Related Products

Alternative Products

Popular Products