3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione
TL;DR: 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione (CAS 368432-84-2) is a chemical compound with molecular formula C18H22N6O3 and molecular weight 370.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-7-(2-phenoxyethyl)-8-piperazin-1-ylpurine-2,6-dione
Also Known As: BAS 04358740, 3-methyl-7-(2-phenoxyethyl)-8-(piperazin-1-yl)-1H-purine-2,6(3H,7H)-dione, 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione, 3-methyl-7-(2-phenoxyethyl)-8-piperazin-1-ylpurine-2,6-dione, 3-METHYL-7-(2-PHENOXYETHYL)-8-(1-PIPERAZINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE
| Molecular Formula | C18H22N6O3 |
|---|---|
| Molecular Weight | 370.18 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.17532 |
| Heavy Atoms | 27 |
| Complexity | 549.0 |
Chemical Identifiers
| CAS Number | 368432-84-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCNCC3)CCOC4=CC=CC=C4 |
| InChIKey | OIUPVAVGNZRYCN-UHFFFAOYSA-N |
Product Overview
3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione (CAS 368432-84-2), with molecular formula C18H22N6O3 and molecular weight 370.18 g/mol. IUPAC: 3-methyl-7-(2-phenoxyethyl)-8-piperazin-1-ylpurine-2,6-dione.
Chemical Property Profile of 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione
Property Insights of 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione. Following Lipinski's Rule of Five, 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione has 2 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 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione?
The CAS number of 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione is 368432-84-2.
What is the molecular formula of 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione?
The molecular formula of 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione is C18H22N6O3.
What is the molecular weight of 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione?
The molecular weight of 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione is 370.18 g/mol.
Where can I buy 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione?
You can request a quote for 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-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-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-7-(2-phenoxy-ethyl)-8-piperazin-1-yl-3,7-dihydro-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.