(E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide
TL;DR: (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide (CAS 612809-18-4) is a chemical compound with molecular formula C15H16N6O3S and molecular weight 360.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide
Also Known As: (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide, 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide, 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N'-[(1E)-1-(thiophen-2-yl)ethylidene]acetohydrazide
| Molecular Formula | C15H16N6O3S |
|---|---|
| Molecular Weight | 360.10 g/mol |
| LogP | 0.0356 |
| Topological Polar Surface Area | 103.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 360.10046 |
| Heavy Atoms | 25 |
| Complexity | 1087.1027 |
Chemical Identifiers
| CAS Number | 612809-18-4 |
|---|---|
| SMILES | C/C(=N\NC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C)/C3=CC=CS3 |
Product Overview
(E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide (CAS 612809-18-4), with molecular formula C15H16N6O3S and molecular weight 360.10 g/mol. IUPAC: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide.
Chemical Property Profile of (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide
Property Insights of (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide
The XLogP value of 0.0356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide. The TPSA of 103.28 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide. Following Lipinski's Rule of Five, (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide has 1 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 (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide?
The CAS number of (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide is 612809-18-4.
What is the molecular formula of (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide?
The molecular formula of (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide is C15H16N6O3S.
What is the molecular weight of (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide?
The molecular weight of (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide is 360.10 g/mol.
Where can I buy (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide?
You can request a quote for (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(1,3-dimethyl-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)-N'-(1-(thiophen-2-yl)ethylidene)acetohydrazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.