BAS 08768434
TL;DR: BAS 08768434 (CAS 957314-10-2) is a chemical compound with molecular formula C15H15N3O4 and molecular weight 301.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(3,5-dimethylphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate
Also Known As: BAS 08768434, methyl 5-(3,5-dimethylphenyl)-4,6-dioxo-1,3a,4,5,6,6a-hexahydropyrrolo[3,4-c]pyrazole-3-carboxylate, methyl 5-(3,5-dimethylphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate
| Molecular Formula | C15H15N3O4 |
|---|---|
| Molecular Weight | 301.11 g/mol |
| LogP | 0.29364 |
| Topological Polar Surface Area | 88.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.10626 |
| Heavy Atoms | 22 |
| Complexity | 705.2478 |
Chemical Identifiers
| CAS Number | 957314-10-2 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N2C(=O)C3C(C2=O)NN=C3C(=O)OC)C |
Product Overview
BAS 08768434 (CAS 957314-10-2), with molecular formula C15H15N3O4 and molecular weight 301.11 g/mol. IUPAC: methyl 5-(3,5-dimethylphenyl)-4,6-dioxo-3a,6a-dihydro-1H-pyrrolo[3,4-c]pyrazole-3-carboxylate.
Chemical Property Profile of BAS 08768434
Property Insights of BAS 08768434
The XLogP value of 0.29364 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 08768434. The TPSA of 88.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 08768434. Following Lipinski's Rule of Five, BAS 08768434 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 BAS 08768434?
The CAS number of BAS 08768434 is 957314-10-2.
What is the molecular formula of BAS 08768434?
The molecular formula of BAS 08768434 is C15H15N3O4.
What is the molecular weight of BAS 08768434?
The molecular weight of BAS 08768434 is 301.11 g/mol.
Where can I buy BAS 08768434?
You can request a quote for BAS 08768434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 08768434?
Yes, KEHONG BIO provides custom synthesis services for BAS 08768434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.