SPL-410

CAT: 0804-HY-128356-02Size: 10 mM - 1 mLDry Ice: NoHazardous: No

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CAT#:0804-HY-128356-02Size:10 mM - 1 mL

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

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Description

SPL-410 is an orally active, highly potent and selective hydroxyethylamine based SPPL2a (Signal Peptide Peptidase Like 2a) inhibitor, with an IC50 of 9 nM[1].

CAS Number

2351886-00-3

UNSPSC

12352005

Target

Others

Type

Reference compound

Related Pathways

Others

Applications

COVID-19-immunoregulation

Field of Research

Inflammation/Immunology

Assay Protocol

https://www.medchemexpress.com/spl-410.html

Concentration

10mM

Purity

99.38

Solubility

DMSO : 190 mg/mL (ultrasonic)

Smiles

N[C@H]([C@@H](O)CN(C1CCC1)S(C2=CC=C(C(C)(C)C)C=C2)(=O)=O)C3=CC=C(OC(F)(F)F)C=C3

Molecular Formula

C24H31F3N2O4S

Molecular Weight

500.57

References & Citations

[1]Velcicky J, et al. Discovery of Orally Active Hydroxyethylamine Based SPPL2a Inhibitors. ACS Med Chem Lett. 2019 May 23;10 (6) :887-892.

Shipping Conditions

Room Temperature

Storage Conditions

4°C (Powder, stored under nitrogen, away from moisture)

Scientific Category

Reference compound1

Clinical Information

No Development Reported

Chemical Information

CID 138911346

CAS Number	2351886-00-3
PubChem CID	138911346
IUPAC Name	N-[(2S,3S)-3-amino-2-hydroxy-3-[4-(trifluoromethoxy)phenyl]propyl]-4-tert-butyl-N-cyclobutylbenzenesulfonamide
Molecular Formula	C24H31F3N2O4S
Molecular Weight	500.6
XLogP	4.8
Topological Polar Surface Area	101
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	9
Heavy Atom Count	34
Formal Charge	0
Complexity	746

SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(C[C@@H]([C@H](C2=CC=C(C=C2)OC(F)(F)F)N)O)C3CCC3

InChI

InChI=1S/C24H31F3N2O4S/c1-23(2,3)17-9-13-20(14-10-17)34(31,32)29(18-5-4-6-18)15-21(30)22(28)16-7-11-19(12-8-16)33-24(25,26)27/h7-14,18,21-22,30H,4-6,15,28H2,1-3H3/t21-,22-/m0/s1

InChIKey

KEEHEUGOPCFXAV-VXKWHMMOSA-N

Chemical Structure

2D Structure

CAS: 2351886-00-3

CID: 138911346

Formula: C24H31F3N2O4S

MW: 500.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	500.6
XLogP3	4.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	9
Exact Mass	500.19566313
Monoisotopic Mass	500.19566313
Topological Polar Surface Area	101 Å²
Heavy Atom Count	34
Formal Charge	0
Complexity	746
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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A18563-50	SPL-410 50mg
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A18563-25	SPL-410 25mg
MBS8560235-01	SPL
BA7791-5	SPL-334
BA8593-5	SPL-707
GTR19234617-01	SPL-IN-1
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