TJ-M2010-5

CAT: 0607-BA6084-100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0607-BA6084-100Size:100 mg

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

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CAS Number

1357471-57-8

Form

A solid

Molecular Formula

C23H26N4OS

Molecular Weight

406.54

Shipping Conditions

Blue ice

Storage Conditions

4°C, protect from light.

Chemical Information

TJ-M2010-5

CAS Number	1357471-57-8
PubChem CID	71542350
IUPAC Name	3-(4-benzylpiperazin-1-yl)-N-(4-phenyl-1,3-thiazol-2-yl)propanamide
Molecular Formula	C23H26N4OS
Molecular Weight	406.5
XLogP	3.4
Topological Polar Surface Area	76.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Heavy Atom Count	29
Formal Charge	0
Complexity	499

SMILES

C1CN(CCN1CCC(=O)NC2=NC(=CS2)C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS/c28-22(25-23-24-21(18-29-23)20-9-5-2-6-10-20)11-12-26-13-15-27(16-14-26)17-19-7-3-1-4-8-19/h1-10,18H,11-17H2,(H,24,25,28)

InChIKey

DTIQJBUDKQVBLT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1357471-57-8

CID: 71542350

Formula: C23H26N4OS

MW: 406.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	406.5
XLogP3	3.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	406.18273264
Monoisotopic Mass	406.18273264
Topological Polar Surface Area	76.7 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	499
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	1
Compound Is Canonicalized	Yes

Catalog	Name
T9765-01	TJ-M2010-5
TBI4919-25MG	TJ-M2010-5, MyD88 inhibitor
sc-73969	IL-17RB (TJ-5)
sc-81847	MPP10 (TJ-1)
PTX25653	Anti-Human CD47/MER6 (TJ-C4GM)
HC359176-01	Research Grade Anti-Human CD47/MER6 (TJ-C4GM)
651100	Anti-Symplekin, Sym-TJ-E150, mouse mab, SN
A135911	Anti-CD47/MER6 (TJ-C4GM) Biosimilar (Monoclonal, IgG)