A2476/0105174
TL;DR: A2476/0105174 (CAS 346644-41-5) is a chemical compound with molecular formula C18H19BrN2O3S and molecular weight 422.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]piperidine-4-carboxylate
Also Known As: A2476/0105174, ethyl 1-[(5Z)-5-(4-bromobenzylidene)-4-oxo-4,5-dihydro-1,3-thiazol-2-yl]piperidine-4-carboxylate, (Z)-ethyl 1-(5-(4-bromobenzylidene)-4-oxo-4,5-dihydrothiazol-2-yl)piperidine-4-carboxylate, ethyl 1-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]piperidine-4-carboxylate
| Molecular Formula | C18H19BrN2O3S |
|---|---|
| Molecular Weight | 422.03 g/mol |
| LogP | 3.6945 |
| Topological Polar Surface Area | 58.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 422.02997 |
| Heavy Atoms | 25 |
| Complexity | 722.3417 |
Chemical Identifiers
| CAS Number | 346644-41-5 |
|---|---|
| SMILES | CCOC(=O)C1CCN(CC1)C2=NC(=O)/C(=C/C3=CC=C(C=C3)Br)/S2 |
Product Overview
A2476/0105174 (CAS 346644-41-5), with molecular formula C18H19BrN2O3S and molecular weight 422.03 g/mol. IUPAC: ethyl 1-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]piperidine-4-carboxylate.
Chemical Property Profile of A2476/0105174
Property Insights of A2476/0105174
The XLogP value of 3.6945 indicates that A2476/0105174 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.97 Ų, A2476/0105174 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A2476/0105174 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2476/0105174?
The CAS number of A2476/0105174 is 346644-41-5.
What is the molecular formula of A2476/0105174?
The molecular formula of A2476/0105174 is C18H19BrN2O3S.
What is the molecular weight of A2476/0105174?
The molecular weight of A2476/0105174 is 422.03 g/mol.
Where can I buy A2476/0105174?
You can request a quote for A2476/0105174 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2476/0105174?
Yes, KEHONG BIO provides custom synthesis services for A2476/0105174 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.