RefChem:282089
TL;DR: RefChem:282089 (CAS 70454-34-1) is a chemical compound with molecular formula C15H15ClN6O3 and molecular weight 362.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridine-3-carboxamide
Also Known As: 5-26-14-00014 (Beilstein Handbook Reference), 3-Pyridinecarboxamide, 2-chloro-N-(2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)ethyl)-, 2-chloro-N-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridine-3-carboxamide, 2-Chloro-N-[2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)ethyl]pyridine-3-carboxamide, BRN 1180369
| Molecular Formula | C15H15ClN6O3 |
|---|---|
| Molecular Weight | 362.09 g/mol |
| LogP | -0.0879 |
| Topological Polar Surface Area | 103.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.08942 |
| Heavy Atoms | 25 |
| Complexity | 1081.0408 |
Chemical Identifiers
| CAS Number | 70454-34-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCNC(=O)C3=C(N=CC=C3)Cl |
Product Overview
RefChem:282089 (CAS 70454-34-1), with molecular formula C15H15ClN6O3 and molecular weight 362.09 g/mol. IUPAC: 2-chloro-N-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl]pyridine-3-carboxamide.
Chemical Property Profile of RefChem:282089
Property Insights of RefChem:282089
The XLogP value of -0.0879 indicates that RefChem:282089 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.81 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:282089. Following Lipinski's Rule of Five, RefChem:282089 has 1 hydrogen bond donor(s) and 5 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 RefChem:282089?
The CAS number of RefChem:282089 is 70454-34-1.
What is the molecular formula of RefChem:282089?
The molecular formula of RefChem:282089 is C15H15ClN6O3.
What is the molecular weight of RefChem:282089?
The molecular weight of RefChem:282089 is 362.09 g/mol.
Where can I buy RefChem:282089?
You can request a quote for RefChem:282089 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:282089?
Yes, KEHONG BIO provides custom synthesis services for RefChem:282089 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.