RefChem:236216
TL;DR: RefChem:236216 (CAS 54864-49-2) is a chemical compound with molecular formula C16H10N2O6 and molecular weight 326.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
spiro[14-oxa-9,10-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-2,4,6,8-tetraene-11,3'-oxolane]-2',5',13,15-tetrone
Also Known As: spiro[[?]-3,3'-tetrahydrofuran]-2',5'-tetrone, 11a',11b'-Dihydro-11'H-spiro(furan-3,8'-furo(3',4':3,4)pyrrolo(2,1-a)phthalazine)-2,5,9',11'(4H,8a'H)-tetrone, 2,5-dioxo-(3'rC2,10'bt)-4,5,1',10'b-tetrahydro-2'H-spiro[fur, 11a',11b'-Dihydro-11'H-spiro[furan-3,8'-furo[3',4':3,4]pyrrolo[2,1-a]phthalazine]-2,5,9',11'(4H,8a'H)-tetrone, 11a,11b-Dihydro-11H-spiro[furo[3',4':3,4]pyrrolo[2,1-a]phthalazine-8,3'-oxolane]-2',5',9,11(8aH)-tetrone
| Molecular Formula | C16H10N2O6 |
|---|---|
| Molecular Weight | 326.05 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 0 |
| Exact Mass | 326.0539 |
| Heavy Atoms | 24 |
| Complexity | 717.0 |
Chemical Identifiers
| CAS Number | 54864-49-2 |
|---|---|
| SMILES | C1C(=O)OC(=O)C12C3C(C4N2N=CC5=CC=CC=C45)C(=O)OC3=O |
| InChIKey | RFTAQWRCVVHXEW-UHFFFAOYSA-N |
Product Overview
RefChem:236216 (CAS 54864-49-2), with molecular formula C16H10N2O6 and molecular weight 326.05 g/mol. IUPAC: spiro[14-oxa-9,10-diazatetracyclo[8.6.0.02,7.012,16]hexadeca-2,4,6,8-tetraene-11,3'-oxolane]-2',5',13,15-tetrone.
Chemical Property Profile of RefChem:236216
Property Insights of RefChem:236216
The XLogP value of -0.1 indicates that RefChem:236216 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:236216. Following Lipinski's Rule of Five, RefChem:236216 has 0 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 RefChem:236216?
The CAS number of RefChem:236216 is 54864-49-2.
What is the molecular formula of RefChem:236216?
The molecular formula of RefChem:236216 is C16H10N2O6.
What is the molecular weight of RefChem:236216?
The molecular weight of RefChem:236216 is 326.05 g/mol.
Where can I buy RefChem:236216?
You can request a quote for RefChem:236216 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:236216?
Yes, KEHONG BIO provides custom synthesis services for RefChem:236216 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.