AB00668452-01
TL;DR: AB00668452-01 (CAS 1009459-66-8) is a chemical compound with molecular formula C19H16ClN3O3S and molecular weight 401.0601 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide
Also Known As: AB00668452-01, F0561-0357, 2-chloro-N-[2-(4-methoxyphenyl)-5-oxo-2H,4H,6H-5lambda4-thieno[3,4-c]pyrazol-3-yl]benzamide, 2-chloro-N-[2-(4-methoxyphenyl)-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]benzamide, 2-chloro-N-(2-(4-methoxyphenyl)-5-oxido-4,6-dihydro-2H-thieno[3,4-c]pyrazol-3-yl)benzamide
Technical Specifications
| Molecular Formula | C19H16ClN3O3S |
| Molecular Weight | 401.0601 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 401.0601 Da |
| Heavy Atoms | 27 |
| Complexity | 572.0 |
| SMILES | COC1=CC=C(C=C1)N2C(=C3CS(=O)CC3=N2)NC(=O)C4=CC=CC=C4Cl |
| InChIKey | YKAPDXDABBBVGA-UHFFFAOYSA-N |
Chemical Property Profile of AB00668452-01
Property Insights of AB00668452-01
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00668452-01. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668452-01. Following Lipinski's Rule of Five, AB00668452-01 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
What is the CAS number of AB00668452-01?
The CAS number of AB00668452-01 is 1009459-66-8.
What is the molecular formula of AB00668452-01?
The molecular formula of AB00668452-01 is C19H16ClN3O3S.
What is the molecular weight of AB00668452-01?
The molecular weight of AB00668452-01 is 401.0601 g/mol.
Where can I buy AB00668452-01?
You can request a quote for AB00668452-01 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for AB00668452-01?
Yes, CoreyChem provides custom synthesis services for AB00668452-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.