![6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one structure](/static/products/609/609819-46-7.png)
6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one
TL;DR: 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one (CAS 609819-46-7) is a chemical compound with molecular formula C10H12N4O2 and molecular weight 220.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-ethyl-5,5-dimethyl-6-oxa-2,4,8,9-tetrazatricyclo[5.3.1.04,11]undeca-1(11),2,7-trien-10-one
Also Known As: ethyl(dimethyl)[?]one, NCI60_034963, 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one, 3H-4-Oxa-1,2a,5,6-tetraazacyclopent[cd]inden-7(6H)-one, 6-ethyl-3,3-dimethyl- (9CI)
| Molecular Formula | C10H12N4O2 |
|---|---|
| Molecular Weight | 220.10 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 59.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 220.09602 |
| Heavy Atoms | 16 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 609819-46-7 |
|---|---|
| SMILES | CCN1C(=O)C2=C3C(=N1)OC(N3C=N2)(C)C |
| InChIKey | ZASBWXKZSBTFMY-UHFFFAOYSA-N |
Product Overview
6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one (CAS 609819-46-7), with molecular formula C10H12N4O2 and molecular weight 220.10 g/mol. IUPAC: 9-ethyl-5,5-dimethyl-6-oxa-2,4,8,9-tetrazatricyclo[5.3.1.04,11]undeca-1(11),2,7-trien-10-one.
Chemical Property Profile of 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one
Property Insights of 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one. With a topological polar surface area (TPSA) of 59.7 Ų, 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one has 0 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 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one?
The CAS number of 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one is 609819-46-7.
What is the molecular formula of 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one?
The molecular formula of 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one is C10H12N4O2.
What is the molecular weight of 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one?
The molecular weight of 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one is 220.10 g/mol.
Where can I buy 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one?
You can request a quote for 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Ethyl-3,3-dimethyl-4-oxa-1,2a,5,6-tetraazacyclopenta[cd]inden-7(6H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.