BAS 08768421
TL;DR: BAS 08768421 (CAS 956352-38-8) is a chemical compound with molecular formula C17H17N3O6 and molecular weight 359.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(5-acetyl-2-methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate
Also Known As: BAS 08768421, BRD-A02162226-001-01-9, ethyl 5-(5-acetyl-2-methoxyphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate, A3563/0151136, ethyl 5-(5-acetyl-2-methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate
| Molecular Formula | C17H17N3O6 |
|---|---|
| Molecular Weight | 359.11 g/mol |
| LogP | 0.2781 |
| Topological Polar Surface Area | 114.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 359.11172 |
| Heavy Atoms | 26 |
| Complexity | 846.9 |
Chemical Identifiers
| CAS Number | 956352-38-8 |
|---|---|
| SMILES | CCOC(=O)C1=NNC2C1C(=O)N(C2=O)C3=C(C=CC(=C3)C(=O)C)OC |
Product Overview
BAS 08768421 (CAS 956352-38-8), with molecular formula C17H17N3O6 and molecular weight 359.11 g/mol. IUPAC: ethyl 5-(5-acetyl-2-methoxyphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate.
Chemical Property Profile of BAS 08768421
Property Insights of BAS 08768421
The XLogP value of 0.2781 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 08768421. The TPSA of 114.37 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08768421. Following Lipinski's Rule of Five, BAS 08768421 has 1 hydrogen bond donor(s) and 8 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 BAS 08768421?
The CAS number of BAS 08768421 is 956352-38-8.
What is the molecular formula of BAS 08768421?
The molecular formula of BAS 08768421 is C17H17N3O6.
What is the molecular weight of BAS 08768421?
The molecular weight of BAS 08768421 is 359.11 g/mol.
Where can I buy BAS 08768421?
You can request a quote for BAS 08768421 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08768421?
Yes, KEHONG BIO provides custom synthesis services for BAS 08768421 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.