Products for Research Use Only
RegisterLogin

Antibacterial agent 252 (hydrochloride)

CAT: 0804-HY-168626ASize: 1 EachDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0804-HY-168626ASize:1 Each
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
Antibacterial agent 252 hydrochloride is an amino acid derivative with antibacterial activity. Antibacterial agent 252 hydrochloride enhances the killing of colistin sulfate against a variety of gram-negative bacteria by targeting the bacterial membrane[1].
CAS Number
2841472-37-3
UNSPSC
12352101
Target
Bacterial
Type
Reference compound
Related Pathways
Anti-infection
Field of Research
Infection
Assay Protocol
https://www.medchemexpress.com/antibacterial-agent-252-hydrochloride.html
Smiles
O=C(CCCCN)N(C1=NC(C2=CC=C(F)C=C2F)=CS1)C3=CC=C(C(F)(F)F)C=C3.Cl
Molecular Formula
C21H19ClF5N3OS
Molecular Weight
491.91
References & Citations
[1]Chen Y, et al. 2-Aminobenzothiazole based adjuvant of polymyxin E against Gram-negative bacteria[J]. Bioorganic Chemistry, 2024: 107903.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

5-amino-N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]-N-[4-(trifluoromethyl)phenyl]pentanamide;hydrochloride
CAS Number2841472-37-3
PubChem CID165390597
IUPAC Name5-amino-N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]-N-[4-(trifluoromethyl)phenyl]pentanamide;hydrochloride
Molecular FormulaC21H19ClF5N3OS
Molecular Weight491.9
Topological Polar Surface Area87.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Heavy Atom Count32
Formal Charge0
Complexity588
SMILES
C1=CC(=CC=C1C(F)(F)F)N(C2=NC(=CS2)C3=C(C=C(C=C3)F)F)C(=O)CCCCN.Cl
InChI
InChI=1S/C21H18F5N3OS.ClH/c22-14-6-9-16(17(23)11-14)18-12-31-20(28-18)29(19(30)3-1-2-10-27)15-7-4-13(5-8-15)21(24,25)26;/h4-9,11-12H,1-3,10,27H2;1H
InChIKey
CMKGUMIQIFZAJI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-amino-N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]-N-[4-(trifluoromethyl)phenyl]pentanamide;hydrochloride
CAS: 2841472-37-3
CID: 165390597
Formula: C21H19ClF5N3OS
MW: 491.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight491.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count7
Exact Mass491.0857519
Monoisotopic Mass491.0857519
Topological Polar Surface Area87.5 Ų
Heavy Atom Count32
Formal Charge0
Complexity588
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Related Products

CatalogName
HY-163708Antibacterial agent
HY-164441Anticancer agent 252
HY-178368Antibacterial agent 293
HY-174852Antibacterial agent 285
HY-173238Antibacterial agent 273
HY-173080Antibacterial agent 267
HY-172793Antibacterial agent 276
HY-170760Antibacterial agent 258
HY-168955Antibacterial agent 269
HY-168853Antibacterial agent 261

Alternative Products

CatalogName
GTR19273838-01Antibacterial agent 307 hydrochloride
T201537-01Antibacterial agent 252 hydrochloride
GTR19262817-01Antibacterial agent
T210853-01Antibacterial agent 283
T210404-01Antibacterial agent 230
T210202-01Antibacterial agent 222
T210114-01Antibacterial agent 215
T210052-01Antibacterial agent 224
T209715-01Antibacterial agent 200
T209463-01Antibacterial agent 196

Popular Products