Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)
TL;DR: Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) (CAS 126480-53-3) is a chemical compound with molecular formula C14H21ClN6O2 and molecular weight 340.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-imino-2-piperidin-1-ylethyl)-1,3-dimethylpurine-2,6-dione;hydrochloride
Also Known As: Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1), 7-(2-imino-2-piperidin-1-ylethyl)-1,3-dimethylpurine-2,6-dione;hydrochloride, 7-(2-imino-2-piperidin-1-ylethyl)-1,3-dimethylpurine-2,6-dione hydrochloride, 7-[2-imino-2-(1-piperidyl)ethyl]-1,3-dimethyl-purine-2,6-dione Hydrochloride, 7-[2-Imino-2-(piperidin-1-yl)ethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione--hydrogen chloride (1/1)
| Molecular Formula | C14H21ClN6O2 |
|---|---|
| Molecular Weight | 340.14 g/mol |
| LogP | 0.31867 |
| Topological Polar Surface Area | 88.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 340.14145 |
| Heavy Atoms | 23 |
| Complexity | 843.29517 |
Chemical Identifiers
| CAS Number | 126480-53-3 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=N)N3CCCCC3.Cl |
Product Overview
Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) (CAS 126480-53-3), with molecular formula C14H21ClN6O2 and molecular weight 340.14 g/mol. IUPAC: 7-(2-imino-2-piperidin-1-ylethyl)-1,3-dimethylpurine-2,6-dione;hydrochloride.
Chemical Property Profile of Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)
Property Insights of Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)
The XLogP value of 0.31867 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1). The TPSA of 88.91 Ų falls within the moderate polarity range, balancing permeability and solubility for Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1). Following Lipinski's Rule of Five, Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) has 1 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 Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)?
The CAS number of Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) is 126480-53-3.
What is the molecular formula of Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)?
The molecular formula of Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) is C14H21ClN6O2.
What is the molecular weight of Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)?
The molecular weight of Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) is 340.14 g/mol.
Where can I buy Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)?
You can request a quote for Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1)?
Yes, KEHONG BIO provides custom synthesis services for Piperidine, 1-(1-imino-2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, hydrochloride, hydrate (1:1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.