AB00684460-01
TL;DR: AB00684460-01 (CAS 1007194-00-4) is a chemical compound with molecular formula C22H23N3O5S and molecular weight 441.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]acetamide
Also Known As: AB00684460-01, F0561-0033, 2-(3,4-dimethoxyphenyl)-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]acetamide, 2-(3,4-dimethoxyphenyl)-N-(2-(4-methoxyphenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)acetamide, 2-(3,4-dimethoxyphenyl)-N-[2-(4-methoxyphenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]acetamide
| Molecular Formula | C22H23N3O5S |
|---|---|
| Molecular Weight | 441.14 g/mol |
| LogP | 2.8416 |
| Topological Polar Surface Area | 91.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.13583 |
| Heavy Atoms | 31 |
| Complexity | 1140.7933 |
Chemical Identifiers
| CAS Number | 1007194-00-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=C3CS(=O)CC3=N2)NC(=O)CC4=CC(=C(C=C4)OC)OC |
Product Overview
AB00684460-01 (CAS 1007194-00-4), with molecular formula C22H23N3O5S and molecular weight 441.14 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]acetamide.
Chemical Property Profile of AB00684460-01
Property Insights of AB00684460-01
The XLogP value of 2.8416 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00684460-01. The TPSA of 91.68 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00684460-01. Following Lipinski's Rule of Five, AB00684460-01 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 AB00684460-01?
The CAS number of AB00684460-01 is 1007194-00-4.
What is the molecular formula of AB00684460-01?
The molecular formula of AB00684460-01 is C22H23N3O5S.
What is the molecular weight of AB00684460-01?
The molecular weight of AB00684460-01 is 441.14 g/mol.
Where can I buy AB00684460-01?
You can request a quote for AB00684460-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00684460-01?
Yes, KEHONG BIO provides custom synthesis services for AB00684460-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.