BAS 02224094
TL;DR: BAS 02224094 (CAS 368841-22-9) is a chemical compound with molecular formula C19H18ClN5O3 and molecular weight 399.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(4-chlorophenyl)methyl]-8-(furan-2-ylmethylamino)-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 02224094, VU0488961-1, AB00685681-01, AB00685681-02, 7-(4-chlorobenzyl)-8-[(2-furylmethyl)amino]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C19H18ClN5O3 |
|---|---|
| Molecular Weight | 399.11 g/mol |
| LogP | 2.3405 |
| Topological Polar Surface Area | 86.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1098 |
| Heavy Atoms | 28 |
| Complexity | 1250.1943 |
Chemical Identifiers
| CAS Number | 368841-22-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCC3=CC=CO3)CC4=CC=C(C=C4)Cl |
Product Overview
BAS 02224094 (CAS 368841-22-9), with molecular formula C19H18ClN5O3 and molecular weight 399.11 g/mol. IUPAC: 7-[(4-chlorophenyl)methyl]-8-(furan-2-ylmethylamino)-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 02224094
Property Insights of BAS 02224094
The XLogP value of 2.3405 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 02224094. The TPSA of 86.99 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02224094. Following Lipinski's Rule of Five, BAS 02224094 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 BAS 02224094?
The CAS number of BAS 02224094 is 368841-22-9.
What is the molecular formula of BAS 02224094?
The molecular formula of BAS 02224094 is C19H18ClN5O3.
What is the molecular weight of BAS 02224094?
The molecular weight of BAS 02224094 is 399.11 g/mol.
Where can I buy BAS 02224094?
You can request a quote for BAS 02224094 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02224094?
Yes, KEHONG BIO provides custom synthesis services for BAS 02224094 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.