AB00157730-02
TL;DR: AB00157730-02 (CAS 958703-85-0) is a chemical compound with molecular formula C21H20FN3O3S and molecular weight 413.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-fluorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-propan-2-yloxybenzamide
Also Known As: AB00157730-02, F0561-0761, N-(2-(4-fluorophenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-isopropoxybenzamide, N-[2-(4-fluorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-propan-2-yloxybenzamide
| Molecular Formula | C21H20FN3O3S |
|---|---|
| Molecular Weight | 413.12 g/mol |
| LogP | 3.8132 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.12094 |
| Heavy Atoms | 29 |
| Complexity | 1075.8008 |
Chemical Identifiers
| CAS Number | 958703-85-0 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(=O)NC2=C3CS(=O)CC3=NN2C4=CC=C(C=C4)F |
Product Overview
AB00157730-02 (CAS 958703-85-0), with molecular formula C21H20FN3O3S and molecular weight 413.12 g/mol. IUPAC: N-[2-(4-fluorophenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-propan-2-yloxybenzamide.
Chemical Property Profile of AB00157730-02
Property Insights of AB00157730-02
The XLogP value of 3.8132 indicates that AB00157730-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00157730-02. Following Lipinski's Rule of Five, AB00157730-02 has 1 hydrogen bond donor(s) and 4 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 AB00157730-02?
The CAS number of AB00157730-02 is 958703-85-0.
What is the molecular formula of AB00157730-02?
The molecular formula of AB00157730-02 is C21H20FN3O3S.
What is the molecular weight of AB00157730-02?
The molecular weight of AB00157730-02 is 413.12 g/mol.
Where can I buy AB00157730-02?
You can request a quote for AB00157730-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00157730-02?
Yes, KEHONG BIO provides custom synthesis services for AB00157730-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.