UPCMLD0ENAT5829999:001
TL;DR: UPCMLD0ENAT5829999:001 (CAS 893945-43-2) is a chemical compound with molecular formula C20H24N6O5 and molecular weight 428.18 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-oxopropyl)purine-2,6-dione
Also Known As: UPCMLD0ENAT5829999:001, 8-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-1,3-dimethyl-7-(2-oxopropyl)purine-2,6-dione, 8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-oxopropyl)-3,7-dihydro-1H-purine-2,6-dione, 8-((4-(furan-2-carbonyl)piperazin-1-yl)methyl)-1,3-dimethyl-7-(2-oxopropyl)-1H-purine-2,6(3H,7H)-dione, 8-{[4-(2-furylcarbonyl)piperazinyl]methyl}-1,3-dimethyl-7-(2-oxopropyl)-1,3,7- trihydropurine-2,6-dione
| Molecular Formula | C20H24N6O5 |
|---|---|
| Molecular Weight | 428.18 g/mol |
| LogP | -0.4263 |
| Topological Polar Surface Area | 115.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 428.18082 |
| Heavy Atoms | 31 |
| Complexity | 1257.9366 |
Chemical Identifiers
| CAS Number | 893945-43-2 |
|---|---|
| SMILES | CC(=O)CN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)C(=O)C4=CC=CO4 |
Product Overview
UPCMLD0ENAT5829999:001 (CAS 893945-43-2), with molecular formula C20H24N6O5 and molecular weight 428.18 g/mol. IUPAC: 8-[[4-(furan-2-carbonyl)piperazin-1-yl]methyl]-1,3-dimethyl-7-(2-oxopropyl)purine-2,6-dione.
Chemical Property Profile of UPCMLD0ENAT5829999:001
Property Insights of UPCMLD0ENAT5829999:001
The XLogP value of -0.4263 indicates that UPCMLD0ENAT5829999:001 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.58 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5829999:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5829999:001 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 UPCMLD0ENAT5829999:001?
The CAS number of UPCMLD0ENAT5829999:001 is 893945-43-2.
What is the molecular formula of UPCMLD0ENAT5829999:001?
The molecular formula of UPCMLD0ENAT5829999:001 is C20H24N6O5.
What is the molecular weight of UPCMLD0ENAT5829999:001?
The molecular weight of UPCMLD0ENAT5829999:001 is 428.18 g/mol.
Where can I buy UPCMLD0ENAT5829999:001?
You can request a quote for UPCMLD0ENAT5829999:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5829999:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5829999:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.