BAS 02080981
TL;DR: BAS 02080981 (CAS 378206-26-9) is a chemical compound with molecular formula C14H21N7O3 and molecular weight 335.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1,3-dimethyl-8-(4-methylpiperazin-1-yl)-2,6-dioxopurin-7-yl]acetamide
Also Known As: BAS 02080981, 2-[1,3-Dimethyl-8-(4-methyl-piperazin-1-yl)-2,6-dioxo-1,2,3,6-tetrahydro-purin-7-yl]-acetamide, 2-[1,3-dimethyl-8-(4-methylpiperazin-1-yl)-2,6-dioxopurin-7-yl]acetamide, 2-[1,3-dimethyl-8-(4-methylpiperazinyl)-2,6-dioxo-1,3,7-trihydropurin-7-yl]ace tamide, 2-(1,3-dimethyl-8-(4-methylpiperazin-1-yl)-2,6-dioxo-2,3-dihydro-1H-purin-7(6H)-yl)acetamide
| Molecular Formula | C14H21N7O3 |
|---|---|
| Molecular Weight | 335.17 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.1706 |
| Heavy Atoms | 24 |
| Complexity | 548.0 |
Chemical Identifiers
| CAS Number | 378206-26-9 |
|---|---|
| SMILES | CN1CCN(CC1)C2=NC3=C(N2CC(=O)N)C(=O)N(C(=O)N3C)C |
| InChIKey | OAZYZNIFBMDSFR-UHFFFAOYSA-N |
Product Overview
BAS 02080981 (CAS 378206-26-9), with molecular formula C14H21N7O3 and molecular weight 335.17 g/mol. IUPAC: 2-[1,3-dimethyl-8-(4-methylpiperazin-1-yl)-2,6-dioxopurin-7-yl]acetamide.
Chemical Property Profile of BAS 02080981
Property Insights of BAS 02080981
The XLogP value of -1.1 indicates that BAS 02080981 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02080981. Following Lipinski's Rule of Five, BAS 02080981 has 1 hydrogen bond donor(s) and 6 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 02080981?
The CAS number of BAS 02080981 is 378206-26-9.
What is the molecular formula of BAS 02080981?
The molecular formula of BAS 02080981 is C14H21N7O3.
What is the molecular weight of BAS 02080981?
The molecular weight of BAS 02080981 is 335.17 g/mol.
Where can I buy BAS 02080981?
You can request a quote for BAS 02080981 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02080981?
Yes, KEHONG BIO provides custom synthesis services for BAS 02080981 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.