AB00137309-02
TL;DR: AB00137309-02 (CAS 391866-53-8) is a chemical compound with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethoxy-N-[2-(4-methoxyphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: AB00137309-02, F0453-0493, 2,6-dimethoxy-N-(2-(4-methoxyphenyl)-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide, 2,6-dimethoxy-N-[2-(4-methoxyphenyl)-2H,4H,6H-thieno[3,4-c]pyrazol-3-yl]benzamide, 2,6-dimethoxy-N-[2-(4-methoxyphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
| Molecular Formula | C21H21N3O4S |
|---|---|
| Molecular Weight | 411.13 g/mol |
| LogP | 3.8972 |
| Topological Polar Surface Area | 74.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 411.12527 |
| Heavy Atoms | 29 |
| Complexity | 1024.575 |
Chemical Identifiers
| CAS Number | 391866-53-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=C3CSCC3=N2)NC(=O)C4=C(C=CC=C4OC)OC |
Product Overview
AB00137309-02 (CAS 391866-53-8), with molecular formula C21H21N3O4S and molecular weight 411.13 g/mol. IUPAC: 2,6-dimethoxy-N-[2-(4-methoxyphenyl)-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide.
Chemical Property Profile of AB00137309-02
Property Insights of AB00137309-02
The XLogP value of 3.8972 indicates that AB00137309-02 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.61 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00137309-02. Following Lipinski's Rule of Five, AB00137309-02 has 1 hydrogen bond donor(s) and 6 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 AB00137309-02?
The CAS number of AB00137309-02 is 391866-53-8.
What is the molecular formula of AB00137309-02?
The molecular formula of AB00137309-02 is C21H21N3O4S.
What is the molecular weight of AB00137309-02?
The molecular weight of AB00137309-02 is 411.13 g/mol.
Where can I buy AB00137309-02?
You can request a quote for AB00137309-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00137309-02?
Yes, KEHONG BIO provides custom synthesis services for AB00137309-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.