![1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone structure](/static/products/896/896814-50-9.png)
1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone
TL;DR: 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone (CAS 896814-50-9) is a chemical compound with molecular formula C20H23N5O4 and molecular weight 397.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7'-ethyl-1,3,6',11'-tetramethylspiro[1,3-diazinane-5,5'-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),9,11,13-tetraene]-2,2',4,6-tetrone
Also Known As: 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone, 1''-ethyl-1,2'',3,10''-tetramethylspiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone, 1-ethyl-1'',2,3'',10-tetramethyl-spiro[2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine-3,5''-hexahydropyrimidine]-2'',4'',5,6''-diquinone, 1-ethyl-1',2,3',10-tetramethyl-1,2-dihydro-1'H-spiro[dipyrido[1,2-a:2',3'-d]pyrimidine-3,5'-pyrimidine]-2',4',5,6'(3'H,4H)-tetraone, 1-ethyl-1',2,3',10-tetramethyl-2H,2'H,4H-spiro[dipyrido[1,2-a:2',3'-d]pyrimidine-3,5'-pyrimidine]-2',4',5,6'(1H,1'H,3'H)-tetrone
| Molecular Formula | C20H23N5O4 |
|---|---|
| Molecular Weight | 397.18 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 93.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 397.17502 |
| Heavy Atoms | 29 |
| Complexity | 965.0 |
Chemical Identifiers
| CAS Number | 896814-50-9 |
|---|---|
| SMILES | CCN1C(C2(CC3=C1N=C4C(=CC=CN4C3=O)C)C(=O)N(C(=O)N(C2=O)C)C)C |
| InChIKey | WOHLPNVZOONGOO-UHFFFAOYSA-N |
Product Overview
1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone (CAS 896814-50-9), with molecular formula C20H23N5O4 and molecular weight 397.18 g/mol. IUPAC: 7'-ethyl-1,3,6',11'-tetramethylspiro[1,3-diazinane-5,5'-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),9,11,13-tetraene]-2,2',4,6-tetrone.
Chemical Property Profile of 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone
Property Insights of 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone. The TPSA of 93.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone. Following Lipinski's Rule of Five, 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone 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 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone?
The CAS number of 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone is 896814-50-9.
What is the molecular formula of 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone?
The molecular formula of 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone is C20H23N5O4.
What is the molecular weight of 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone?
The molecular weight of 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone is 397.18 g/mol.
Where can I buy 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone?
You can request a quote for 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone?
Yes, KEHONG BIO provides custom synthesis services for 1''-ethyl-1,2'',3,10''-tetramethyl-spiro[1,3-diazinane-5,3''-2,4-dihydrodipyrido[4,3-b:1'',2''-f]pyrimidine]-2,4,5'',6-tetrone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.