BAS 03033738
TL;DR: BAS 03033738 (CAS 349441-38-9) is a chemical compound with molecular formula C21H24N6O5 and molecular weight 440.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione
Also Known As: BAS 03033738, 7-{2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione, 7-(2-(4-(benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-oxoethyl)-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 7-(2-{4-[(2H-1,3-BENZODIOXOL-5-YL)METHYL]PIPERAZIN-1-YL}-2-OXOETHYL)-1,3-DIMETHYL-2,3,6,7-TETRAHYDRO-1H-PURINE-2,6-DIONE, 7-{2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C21H24N6O5 |
|---|---|
| Molecular Weight | 440.18 g/mol |
| LogP | -0.4932 |
| Topological Polar Surface Area | 103.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 440.18082 |
| Heavy Atoms | 32 |
| Complexity | 1314.687 |
Chemical Identifiers
| CAS Number | 349441-38-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5 |
Product Overview
BAS 03033738 (CAS 349441-38-9), with molecular formula C21H24N6O5 and molecular weight 440.18 g/mol. IUPAC: 7-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of BAS 03033738
Property Insights of BAS 03033738
The XLogP value of -0.4932 indicates that BAS 03033738 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.83 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03033738. Following Lipinski's Rule of Five, BAS 03033738 has 0 hydrogen bond donor(s) and 7 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 03033738?
The CAS number of BAS 03033738 is 349441-38-9.
What is the molecular formula of BAS 03033738?
The molecular formula of BAS 03033738 is C21H24N6O5.
What is the molecular weight of BAS 03033738?
The molecular weight of BAS 03033738 is 440.18 g/mol.
Where can I buy BAS 03033738?
You can request a quote for BAS 03033738 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03033738?
Yes, KEHONG BIO provides custom synthesis services for BAS 03033738 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.