BAS 07804479
TL;DR: BAS 07804479 (CAS 677294-86-9) is a chemical compound with molecular formula C14H12N2O5 and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4,6-dioxo-5-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-3-carboxylate
Also Known As: BAS 07804479, ethyl 4,6-dioxo-5-phenyl-4,5,6,6a-tetrahydro-3ah-pyrrolo[3,4-d]isoxazole-3-carboxylate, 4,6-Dioxo-5-phenyl-4,5,6,6a-tetrahydro-3aH-pyrrolo[3,4-d]isoxazole-3-carboxylic, ethyl 4,6-dioxo-5-phenyl-3,5,3a,6a-tetrahydro-3-oxa-2,5-diazapentalenecarboxyl ate, ethyl 4,6-dioxo-5-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-3-carboxylate
| Molecular Formula | C14H12N2O5 |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 0.4939 |
| Topological Polar Surface Area | 85.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.07462 |
| Heavy Atoms | 21 |
| Complexity | 640.0243 |
Chemical Identifiers
| CAS Number | 677294-86-9 |
|---|---|
| SMILES | CCOC(=O)C1=NOC2C1C(=O)N(C2=O)C3=CC=CC=C3 |
Product Overview
BAS 07804479 (CAS 677294-86-9), with molecular formula C14H12N2O5 and molecular weight 288.07 g/mol. IUPAC: ethyl 4,6-dioxo-5-phenyl-3a,6a-dihydropyrrolo[3,4-d][1,2]oxazole-3-carboxylate.
Chemical Property Profile of BAS 07804479
Property Insights of BAS 07804479
The XLogP value of 0.4939 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 07804479. The TPSA of 85.27 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 07804479. Following Lipinski's Rule of Five, BAS 07804479 has 0 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 07804479?
The CAS number of BAS 07804479 is 677294-86-9.
What is the molecular formula of BAS 07804479?
The molecular formula of BAS 07804479 is C14H12N2O5.
What is the molecular weight of BAS 07804479?
The molecular weight of BAS 07804479 is 288.07 g/mol.
Where can I buy BAS 07804479?
You can request a quote for BAS 07804479 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 07804479?
Yes, KEHONG BIO provides custom synthesis services for BAS 07804479 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.