BAS 10854071
TL;DR: BAS 10854071 (CAS 851941-73-6) is a chemical compound with molecular formula C21H28N6O4 and molecular weight 428.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-1,3-dimethyl-7-(2-methylpropyl)purine-2,6-dione
Also Known As: BAS 10854071, UPCMLD0ENAT5837455:001, 8-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-7-isobutyl-1,3-dimethyl-1H-purine-2,6(3H,7H)-dione, 8-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-1,3-dimethyl-7-(2-methylpropyl)purine-2,6-dione, 8-{[4-(2-furoyl)piperazin-1-yl]methyl}-7-isobutyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
| Molecular Formula | C21H28N6O4 |
|---|---|
| Molecular Weight | 428.22 g/mol |
| LogP | 0.6407 |
| Topological Polar Surface Area | 98.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.2172 |
| Heavy Atoms | 31 |
| Complexity | 1209.4352 |
Chemical Identifiers
| CAS Number | 851941-73-6 |
|---|---|
| SMILES | CC(C)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)C(=O)C4=CC=CO4 |
Product Overview
BAS 10854071 (CAS 851941-73-6), with molecular formula C21H28N6O4 and molecular weight 428.22 g/mol. IUPAC: 8-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-1,3-dimethyl-7-(2-methylpropyl)purine-2,6-dione.
Chemical Property Profile of BAS 10854071
Property Insights of BAS 10854071
The XLogP value of 0.6407 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 10854071. The TPSA of 98.51 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 10854071. Following Lipinski's Rule of Five, BAS 10854071 has 0 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 10854071?
The CAS number of BAS 10854071 is 851941-73-6.
What is the molecular formula of BAS 10854071?
The molecular formula of BAS 10854071 is C21H28N6O4.
What is the molecular weight of BAS 10854071?
The molecular weight of BAS 10854071 is 428.22 g/mol.
Where can I buy BAS 10854071?
You can request a quote for BAS 10854071 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 10854071?
Yes, KEHONG BIO provides custom synthesis services for BAS 10854071 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.