AB00164217-02
TL;DR: AB00164217-02 (CAS 476459-09-3) is a chemical compound with molecular formula C21H20ClN3O2S and molecular weight 413.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chlorophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-propan-2-yloxybenzamide
Also Known As: AB00164217-02, F0529-0106, N-(2-(4-chlorophenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)-4-isopropoxybenzamide, N-[2-(4-chlorophenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]-4-(propan-2-yloxy)benzamide, N-[2-(4-chlorophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-propan-2-yloxybenzamide
| Molecular Formula | C21H20ClN3O2S |
|---|---|
| Molecular Weight | 413.10 g/mol |
| LogP | 5.312 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 413.09647 |
| Heavy Atoms | 28 |
| Complexity | 997.74023 |
Chemical Identifiers
| CAS Number | 476459-09-3 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(=O)NC2=C3CSCC3=NN2C4=CC=C(C=C4)Cl |
Product Overview
AB00164217-02 (CAS 476459-09-3), with molecular formula C21H20ClN3O2S and molecular weight 413.10 g/mol. IUPAC: N-[2-(4-chlorophenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-4-propan-2-yloxybenzamide.
Chemical Property Profile of AB00164217-02
Property Insights of AB00164217-02
The XLogP value of 5.312 indicates that AB00164217-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.15 Ų, AB00164217-02 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00164217-02 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00164217-02?
The CAS number of AB00164217-02 is 476459-09-3.
What is the molecular formula of AB00164217-02?
The molecular formula of AB00164217-02 is C21H20ClN3O2S.
What is the molecular weight of AB00164217-02?
The molecular weight of AB00164217-02 is 413.10 g/mol.
Where can I buy AB00164217-02?
You can request a quote for AB00164217-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00164217-02?
Yes, KEHONG BIO provides custom synthesis services for AB00164217-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.