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SphK1&2-IN-1 structure
Fine Chemical

SphK1&2-IN-1

TL;DR: SphK1&2-IN-1 (CAS 1415662-57-5) is a chemical compound with molecular formula C14H14N2O3S and molecular weight 290.0725 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(E)-3-(3,4-dimethoxyphenyl)-N-(1,3-thiazol-2-yl)prop-2-enamide

Also Known As: SphK1&2-IN-1, IDI1_011242, WAY-272077?, (E)-3-(3,4-dimethoxyphenyl)-N-(thiazol-2-yl)acrylamide, (2E)-3-(3,4-Dimethoxyphenyl)-N-2-thiazolyl-2-propenamide

CAS Number
1415662-57-5
Molecular Formula
C14H14N2O3S
Molecular Weight
290.0725 g/mol
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Technical Specifications

Molecular FormulaC14H14N2O3S
Molecular Weight290.0725 g/mol
XLogP2.5
Topological Polar Surface Area (TPSA)88.7 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds5
Exact Mass290.0725 Da
Heavy Atoms20
Complexity351.0
SMILESCOC1=C(C=C(C=C1)/C=C/C(=O)NC2=NC=CS2)OC
InChIKeySMRXKMFZQYOXSX-GQCTYLIASA-N

Chemical Property Profile of SphK1&2-IN-1

XLogP
2.5
TPSA (Topological Polar Surface Area)
88.7
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
5
Heavy Atoms
20
Complexity
351.0
Exact Mass
290.0725
Monoisotopic Mass
290.0725
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of SphK1&2-IN-1

The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SphK1&2-IN-1. The TPSA of 88.7 Ų falls within the moderate polarity range, balancing permeability and solubility for SphK1&2-IN-1. Following Lipinski's Rule of Five, SphK1&2-IN-1 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of SphK1&2-IN-1?

The CAS number of SphK1&2-IN-1 is 1415662-57-5.

What is the molecular formula of SphK1&2-IN-1?

The molecular formula of SphK1&2-IN-1 is C14H14N2O3S.

What is the molecular weight of SphK1&2-IN-1?

The molecular weight of SphK1&2-IN-1 is 290.0725 g/mol.

Where can I buy SphK1&2-IN-1?

You can request a quote for SphK1&2-IN-1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for SphK1&2-IN-1?

Yes, CoreyChem provides custom synthesis services for SphK1&2-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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