9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine
TL;DR: 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine (CAS 181034-30-0) is a chemical compound with molecular formula C11H16ClN5 and molecular weight 253.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(2-chloroethyl)-N,N-diethylpurin-6-amine
Also Known As: 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine, 9-(2-chloroethyl)-N,N-diethylpurin-6-amine
| Molecular Formula | C11H16ClN5 |
|---|---|
| Molecular Weight | 253.11 g/mol |
| LogP | 1.9113 |
| Topological Polar Surface Area | 46.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.10942 |
| Heavy Atoms | 17 |
| Complexity | 491.56747 |
Chemical Identifiers
| CAS Number | 181034-30-0 |
|---|---|
| SMILES | CCN(CC)C1=NC=NC2=C1N=CN2CCCl |
Product Overview
9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine (CAS 181034-30-0), with molecular formula C11H16ClN5 and molecular weight 253.11 g/mol. IUPAC: 9-(2-chloroethyl)-N,N-diethylpurin-6-amine.
Chemical Property Profile of 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine
Property Insights of 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine
The XLogP value of 1.9113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine. With a topological polar surface area (TPSA) of 46.84 Ų, 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine 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 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine?
The CAS number of 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine is 181034-30-0.
What is the molecular formula of 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine?
The molecular formula of 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine is C11H16ClN5.
What is the molecular weight of 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine?
The molecular weight of 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine is 253.11 g/mol.
Where can I buy 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine?
You can request a quote for 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-(2-chloroethyl)-N,N-diethyl-9H-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.