![(1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide structure](/static/products/372/372978-69-3.png)
(1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide
TL;DR: (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide (CAS 372978-69-3) is a chemical compound with molecular formula C17H16N8O4 and molecular weight 396.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide
Also Known As: (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide, (Z)-N'-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-2-((4-methoxyphenyl)amino)-2-oxoacetohydrazonoyl cyanide, (Z)-N-(1,3-DIMETHYL-2,6-DIOXO-2,3,6,7-TETRAHYDRO-1H-PURIN-8-YL)-1-[(4-METHOXYPHENYL)CARBAMOYL]METHANECARBOHYDRAZONOYL CYANIDE, 2-cyano-2-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)hydrazinylidene]-N-(4-methoxyphenyl)acetamide
| Molecular Formula | C17H16N8O4 |
|---|---|
| Molecular Weight | 396.13 g/mol |
| LogP | -0.10092 |
| Topological Polar Surface Area | 159.19 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.12946 |
| Heavy Atoms | 29 |
| Complexity | 1274.226 |
Chemical Identifiers
| CAS Number | 372978-69-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N/N=C(/C#N)\C(=O)NC3=CC=C(C=C3)OC |
Product Overview
(1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide (CAS 372978-69-3), with molecular formula C17H16N8O4 and molecular weight 396.13 g/mol. IUPAC: (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide.
Chemical Property Profile of (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide
Property Insights of (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide
The XLogP value of -0.10092 indicates that (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 159.19 Ų indicates high polarity, suggesting (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide has 3 hydrogen bond donor(s) and 8 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 (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide?
The CAS number of (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide is 372978-69-3.
What is the molecular formula of (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide?
The molecular formula of (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide is C17H16N8O4.
What is the molecular weight of (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide?
The molecular weight of (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide is 396.13 g/mol.
Where can I buy (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide?
You can request a quote for (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide?
Yes, KEHONG BIO provides custom synthesis services for (1Z)-N-[(1,3-dimethyl-2,6-dioxo-7H-purin-8-yl)amino]-2-(4-methoxyanilino)-2-oxoethanimidoyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.