![3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione structure](/static/products/370/370873-47-5.png)
3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione (CAS 370873-47-5) is a chemical compound with molecular formula C22H21N7O4 and molecular weight 447.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-8-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl]-7-(2-phenylethyl)purine-2,6-dione
Also Known As: 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione, 3-methyl-8-[2-[1-(4-nitrophenyl)ethylidene]hydrazinyl]-7-phenethyl-purine-2,6-dione, (E)-3-methyl-8-(2-(1-(4-nitrophenyl)ethylidene)hydrazinyl)-7-phenethyl-1H-purine-2,6(3H,7H)-dione
| Molecular Formula | C22H21N7O4 |
|---|---|
| Molecular Weight | 447.17 g/mol |
| LogP | 2.4103 |
| Topological Polar Surface Area | 140.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 447.1655 |
| Heavy Atoms | 33 |
| Complexity | 1465.1494 |
Chemical Identifiers
| CAS Number | 370873-47-5 |
|---|---|
| SMILES | C/C(=N\NC1=NC2=C(N1CCC3=CC=CC=C3)C(=O)NC(=O)N2C)/C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione (CAS 370873-47-5), with molecular formula C22H21N7O4 and molecular weight 447.17 g/mol. IUPAC: 3-methyl-8-[(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl]-7-(2-phenylethyl)purine-2,6-dione.
Chemical Property Profile of 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 2.4103 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 140.21 Ų indicates high polarity, suggesting 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione has 2 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 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione is 370873-47-5.
What is the molecular formula of 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione is C22H21N7O4.
What is the molecular weight of 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione is 447.17 g/mol.
Where can I buy 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-8-{(2E)-2-[1-(4-nitrophenyl)ethylidene]hydrazinyl}-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.