AB00164574-02
TL;DR: AB00164574-02 (CAS 449784-73-0) is a chemical compound with molecular formula C17H21N3O4S and molecular weight 363.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-phenoxyacetamide
Also Known As: AB00164574-02, F0541-0081, N-(2-(tert-butyl)-5,5-dioxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-2-phenoxyacetamide, N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-phenoxyacetamide
| Molecular Formula | C17H21N3O4S |
|---|---|
| Molecular Weight | 363.13 g/mol |
| LogP | 2.084 |
| Topological Polar Surface Area | 90.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.12527 |
| Heavy Atoms | 25 |
| Complexity | 895.9644 |
Chemical Identifiers
| CAS Number | 449784-73-0 |
|---|---|
| SMILES | CC(C)(C)N1C(=C2CS(=O)(=O)CC2=N1)NC(=O)COC3=CC=CC=C3 |
Product Overview
AB00164574-02 (CAS 449784-73-0), with molecular formula C17H21N3O4S and molecular weight 363.13 g/mol. IUPAC: N-(2-tert-butyl-5,5-dioxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl)-2-phenoxyacetamide.
Chemical Property Profile of AB00164574-02
Property Insights of AB00164574-02
The XLogP value of 2.084 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00164574-02. The TPSA of 90.29 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00164574-02. Following Lipinski's Rule of Five, AB00164574-02 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
Frequently Asked Questions
What is the CAS number of AB00164574-02?
The CAS number of AB00164574-02 is 449784-73-0.
What is the molecular formula of AB00164574-02?
The molecular formula of AB00164574-02 is C17H21N3O4S.
What is the molecular weight of AB00164574-02?
The molecular weight of AB00164574-02 is 363.13 g/mol.
Where can I buy AB00164574-02?
You can request a quote for AB00164574-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00164574-02?
Yes, KEHONG BIO provides custom synthesis services for AB00164574-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.