2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium
TL;DR: 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium (CAS 5695-13-6) is a chemical compound with molecular formula C9H12N3O4+ and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-amino-3,8-dioxa-10-aza-1-azoniatricyclo[7.4.0.02,6]trideca-1(9),10,12-triene-4,5-diol
Also Known As: 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium
| Molecular Formula | C9H12N3O4+ |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | -1.832 |
| Topological Polar Surface Area | 101.71 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 226.08278 |
| Heavy Atoms | 16 |
| Complexity | 427.21518 |
Chemical Identifiers
| CAS Number | 5695-13-6 |
|---|---|
| SMILES | C1C2C(C(OC2[N+]3=C(O1)N=C(C=C3)N)O)O |
Product Overview
2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium (CAS 5695-13-6), with molecular formula C9H12N3O4+ and molecular weight 226.08 g/mol. IUPAC: 11-amino-3,8-dioxa-10-aza-1-azoniatricyclo[7.4.0.02,6]trideca-1(9),10,12-triene-4,5-diol.
Chemical Property Profile of 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium
Property Insights of 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium
The XLogP value of -1.832 indicates that 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium. Following Lipinski's Rule of Five, 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium has 3 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 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium?
The CAS number of 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium is 5695-13-6.
What is the molecular formula of 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium?
The molecular formula of 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium is C9H12N3O4+.
What is the molecular weight of 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium?
The molecular weight of 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium is 226.08 g/mol.
Where can I buy 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium?
You can request a quote for 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dihydroxy-2,3,3a,10a-tetrahydro-4H,7H-furo[2,3-d]pyrimido[2,1-b][1,3]oxazin-7-iminium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.