![(6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one structure](/static/products/899/899400-52-3.png)
(6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one
TL;DR: (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one (CAS 899400-52-3) is a chemical compound with molecular formula C12H9N3O2S and molecular weight 259.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Also Known As: (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one, (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-6,7-dihydro-5H-[1,2]oxazolo[2,3-a]pyrimidin-5-one, (6E)-7-Imino-2-methyl-6-[(thiophen-2-yl)methylidene]-6,7-dihydro-5H-[1,2]oxazolo[2,3-a]pyrimidin-5-one, (E)-7-imino-2-methyl-6-(thiophen-2-ylmethylene)-6,7-dihydro-5H-isoxazolo[2,3-a]pyrimidin-5-one, 7-Imino-2-methyl-6-[1-thiophen-2-yl-meth-(E)-ylidene]-6,7-dihydro-isoxazolo[2,3-a]pyrimidin-5-one
| Molecular Formula | C12H9N3O2S |
|---|---|
| Molecular Weight | 259.04 g/mol |
| LogP | 2.19847 |
| Topological Polar Surface Area | 65.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 259.04153 |
| Heavy Atoms | 18 |
| Complexity | 625.7575 |
Chemical Identifiers
| CAS Number | 899400-52-3 |
|---|---|
| SMILES | CC1=CC2=NC(=O)/C(=C/C3=CC=CS3)/C(=N)N2O1 |
Product Overview
(6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one (CAS 899400-52-3), with molecular formula C12H9N3O2S and molecular weight 259.04 g/mol. IUPAC: (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one.
Chemical Property Profile of (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one
Property Insights of (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one
The XLogP value of 2.19847 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one. The TPSA of 65.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one. Following Lipinski's Rule of Five, (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one has 1 hydrogen bond donor(s) and 4 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 (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
The CAS number of (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one is 899400-52-3.
What is the molecular formula of (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
The molecular formula of (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one is C12H9N3O2S.
What is the molecular weight of (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
The molecular weight of (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one is 259.04 g/mol.
Where can I buy (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
You can request a quote for (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one?
Yes, KEHONG BIO provides custom synthesis services for (6E)-7-imino-2-methyl-6-(thiophen-2-ylmethylidene)-[1,2]oxazolo[2,3-a]pyrimidin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.