UPCMLD0ENAT5835583:001
TL;DR: UPCMLD0ENAT5835583:001 (CAS 893970-88-2) is a chemical compound with molecular formula C18H26N6O4 and molecular weight 390.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[1,3-dimethyl-2,6-dioxo-7-(3-oxobutan-2-yl)purin-8-yl]methyl]piperidine-4-carboxamide
Also Known As: UPCMLD0ENAT5835583:001, 1-[[1,3-dimethyl-2,6-dioxo-7-(3-oxobutan-2-yl)purin-8-yl]methyl]piperidine-4-carboxamide, 1-{[1,3-dimethyl-2,6-dioxo-7-(3-oxobutan-2-yl)-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperidine-4-carboxamide, 1-((1,3-dimethyl-2,6-dioxo-7-(3-oxobutan-2-yl)-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl)piperidine-4-carboxamide
| Molecular Formula | C18H26N6O4 |
|---|---|
| Molecular Weight | 390.20 g/mol |
| LogP | -0.719 |
| Topological Polar Surface Area | 125.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.20154 |
| Heavy Atoms | 28 |
| Complexity | 1054.6809 |
Chemical Identifiers
| CAS Number | 893970-88-2 |
|---|---|
| SMILES | CC(C(=O)C)N1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCC(CC3)C(=O)N |
Product Overview
UPCMLD0ENAT5835583:001 (CAS 893970-88-2), with molecular formula C18H26N6O4 and molecular weight 390.20 g/mol. IUPAC: 1-[[1,3-dimethyl-2,6-dioxo-7-(3-oxobutan-2-yl)purin-8-yl]methyl]piperidine-4-carboxamide.
Chemical Property Profile of UPCMLD0ENAT5835583:001
Property Insights of UPCMLD0ENAT5835583:001
The XLogP value of -0.719 indicates that UPCMLD0ENAT5835583:001 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 125.22 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5835583:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5835583:001 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 UPCMLD0ENAT5835583:001?
The CAS number of UPCMLD0ENAT5835583:001 is 893970-88-2.
What is the molecular formula of UPCMLD0ENAT5835583:001?
The molecular formula of UPCMLD0ENAT5835583:001 is C18H26N6O4.
What is the molecular weight of UPCMLD0ENAT5835583:001?
The molecular weight of UPCMLD0ENAT5835583:001 is 390.20 g/mol.
Where can I buy UPCMLD0ENAT5835583:001?
You can request a quote for UPCMLD0ENAT5835583:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5835583:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5835583:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.