BAS 00964833
TL;DR: BAS 00964833 (CAS 330202-48-7) is a chemical compound with molecular formula C15H22N6O2 and molecular weight 318.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[(E)-but-2-enyl]-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione
Also Known As: BAS 00964833, UPCMLD0ENAT5831798:001, (E)-7-(but-2-en-1-yl)-3-methyl-8-(4-methylpiperazin-1-yl)-1H-purine-2,6(3H,7H)-dione, AB01309695-01, F0372-0597
| Molecular Formula | C15H22N6O2 |
|---|---|
| Molecular Weight | 318.18 g/mol |
| LogP | -0.2488 |
| Topological Polar Surface Area | 79.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.18042 |
| Heavy Atoms | 23 |
| Complexity | 851.1999 |
Chemical Identifiers
| CAS Number | 330202-48-7 |
|---|---|
| SMILES | C/C=C/CN1C2=C(N=C1N3CCN(CC3)C)N(C(=O)NC2=O)C |
Product Overview
BAS 00964833 (CAS 330202-48-7), with molecular formula C15H22N6O2 and molecular weight 318.18 g/mol. IUPAC: 7-[(E)-but-2-enyl]-3-methyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione.
Chemical Property Profile of BAS 00964833
Property Insights of BAS 00964833
The XLogP value of -0.2488 indicates that BAS 00964833 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 79.16 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00964833. Following Lipinski's Rule of Five, BAS 00964833 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 00964833?
The CAS number of BAS 00964833 is 330202-48-7.
What is the molecular formula of BAS 00964833?
The molecular formula of BAS 00964833 is C15H22N6O2.
What is the molecular weight of BAS 00964833?
The molecular weight of BAS 00964833 is 318.18 g/mol.
Where can I buy BAS 00964833?
You can request a quote for BAS 00964833 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00964833?
Yes, KEHONG BIO provides custom synthesis services for BAS 00964833 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.