(1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-
TL;DR: (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- (CAS 105774-51-4) is a chemical compound with molecular formula C16H16N6O4 and molecular weight 356.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dihydroxyphenyl)-1-ethyl-9-methyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione
Also Known As: (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-, (3E)-1-ethyl-3-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-9-methyl-2,4-dihydropurino[8,7-c][1,2,4]triazine-6,8-dione, RefChem:1049193, BRN 5658215
| Molecular Formula | C16H16N6O4 |
|---|---|
| Molecular Weight | 356.12 g/mol |
| LogP | 0.0787 |
| Topological Polar Surface Area | 128.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 356.1233 |
| Heavy Atoms | 26 |
| Complexity | 1185.8937 |
Chemical Identifiers
| CAS Number | 105774-51-4 |
|---|---|
| SMILES | CCN1C2=NC3=C(N2CC(=N1)C4=CC(=C(C=C4)O)O)C(=O)NC(=O)N3C |
Product Overview
(1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- (CAS 105774-51-4), with molecular formula C16H16N6O4 and molecular weight 356.12 g/mol. IUPAC: 3-(3,4-dihydroxyphenyl)-1-ethyl-9-methyl-4H-purino[8,7-c][1,2,4]triazine-6,8-dione.
Chemical Property Profile of (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-
Property Insights of (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-
The XLogP value of 0.0787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-. The TPSA of 128.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-. Following Lipinski's Rule of Five, (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- has 3 hydrogen bond donor(s) and 7 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 (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-?
The CAS number of (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- is 105774-51-4.
What is the molecular formula of (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-?
The molecular formula of (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- is C16H16N6O4.
What is the molecular weight of (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-?
The molecular weight of (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- is 356.12 g/mol.
Where can I buy (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-?
You can request a quote for (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl-?
Yes, KEHONG BIO provides custom synthesis services for (1,2,4)Triazino(3,4-f)purine-6,8(7H,9H)-dione, 3-(3,4-dihydroxyphenyl)-1-ethyl-1,4-dihydro-9-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.