7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione (CAS 331666-83-2) is a chemical compound with molecular formula C24H26N6O3 and molecular weight 446.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-benzyl-8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methylpurine-2,6-dione
Also Known As: BAS 00387089, 7-benzyl-8-(4-(4-methoxyphenyl)piperazin-1-yl)-3-methyl-1H-purine-2,6(3H,7H)-dione, VU0488975-1, 7-benzyl-8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione, F1191-0026
| Molecular Formula | C24H26N6O3 |
|---|---|
| Molecular Weight | 446.21 g/mol |
| LogP | 1.8068 |
| Topological Polar Surface Area | 88.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.20663 |
| Heavy Atoms | 33 |
| Complexity | 1380.2347 |
Chemical Identifiers
| CAS Number | 331666-83-2 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)C4=CC=C(C=C4)OC)CC5=CC=CC=C5 |
Product Overview
7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione (CAS 331666-83-2), with molecular formula C24H26N6O3 and molecular weight 446.21 g/mol. IUPAC: 7-benzyl-8-[4-(4-methoxyphenyl)piperazin-1-yl]-3-methylpurine-2,6-dione.
Chemical Property Profile of 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 1.8068 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 88.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione 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 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione is 331666-83-2.
What is the molecular formula of 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione is C24H26N6O3.
What is the molecular weight of 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione is 446.21 g/mol.
Where can I buy 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-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 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 7-Benzyl-8-(4-(4-methoxy-PH)-1-piperazinyl)-3-ME-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.