1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione
TL;DR: 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione (CAS 476480-49-6) is a chemical compound with molecular formula C22H23N5O2 and molecular weight 389.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-pyrrolidin-1-ylpurine-2,6-dione
Also Known As: 1,3-Dimethyl-7-(naphthalen-1-ylmethyl)-8-(pyrrolidin-1-yl)-1H-purine-2,6(3H,7H)-dione, 1,3-DI-ME-7-(1-NAPHTHYL-ME)-8-(1-PYRROLIDINYL)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE, 1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-pyrrolidin-1-ylpurine-2,6-dione, 1,3-dimethyl-7-[(naphthalen-1-yl)methyl]-8-(pyrrolidin-1-yl)-2,3,6,7-tetrahydro-1H-purine-2,6-dione, 1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-(pyrrolidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C22H23N5O2 |
|---|---|
| Molecular Weight | 389.19 g/mol |
| LogP | 2.2354 |
| Topological Polar Surface Area | 65.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.18518 |
| Heavy Atoms | 29 |
| Complexity | 1350.3839 |
Chemical Identifiers
| CAS Number | 476480-49-6 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCC3)CC4=CC=CC5=CC=CC=C54 |
Product Overview
1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione (CAS 476480-49-6), with molecular formula C22H23N5O2 and molecular weight 389.19 g/mol. IUPAC: 1,3-dimethyl-7-(naphthalen-1-ylmethyl)-8-pyrrolidin-1-ylpurine-2,6-dione.
Chemical Property Profile of 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione
Property Insights of 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione
The XLogP value of 2.2354 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione. The TPSA of 65.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione. Following Lipinski's Rule of Five, 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione has 0 hydrogen bond donor(s) and 4 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 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione?
The CAS number of 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione is 476480-49-6.
What is the molecular formula of 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione?
The molecular formula of 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione is C22H23N5O2.
What is the molecular weight of 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione?
The molecular weight of 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione is 389.19 g/mol.
Where can I buy 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione?
You can request a quote for 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-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 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione?
Yes, KEHONG BIO provides custom synthesis services for 1,3-DI-ME-7-(1-Naphthyl-ME)-8-(1-pyrrolidinyl)-3,7-dihydro-1H-purine-2,6-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.