UPCMLD0ENAT5834900:001
TL;DR: UPCMLD0ENAT5834900:001 (CAS 851941-97-4) is a chemical compound with molecular formula C20H32N6O3 and molecular weight 404.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(7-hexyl-1,3-dimethyl-2,6-dioxopurin-8-yl)methyl]piperidine-4-carboxamide
Also Known As: UPCMLD0ENAT5834900:001, 1-[(7-hexyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl]piperidine-4-carboxamide, 1-[(7-hexyl-1,3-dimethyl-2,6-dioxopurin-8-yl)methyl]piperidine-4-carboxamide, 1-[(7-hexyl-1,3-dimethyl-2,6-dioxo-purin-8-yl)methyl]piperidine-4-carboxamide, 1-((7-hexyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl)piperidine-4-carboxamide
| Molecular Formula | C20H32N6O3 |
|---|---|
| Molecular Weight | 404.25 g/mol |
| LogP | 0.7113 |
| Topological Polar Surface Area | 108.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 404.2536 |
| Heavy Atoms | 29 |
| Complexity | 994.2809 |
Chemical Identifiers
| CAS Number | 851941-97-4 |
|---|---|
| SMILES | CCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCC(CC3)C(=O)N |
Product Overview
UPCMLD0ENAT5834900:001 (CAS 851941-97-4), with molecular formula C20H32N6O3 and molecular weight 404.25 g/mol. IUPAC: 1-[(7-hexyl-1,3-dimethyl-2,6-dioxopurin-8-yl)methyl]piperidine-4-carboxamide.
Chemical Property Profile of UPCMLD0ENAT5834900:001
Property Insights of UPCMLD0ENAT5834900:001
The XLogP value of 0.7113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5834900:001. The TPSA of 108.15 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5834900:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5834900:001 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 UPCMLD0ENAT5834900:001?
The CAS number of UPCMLD0ENAT5834900:001 is 851941-97-4.
What is the molecular formula of UPCMLD0ENAT5834900:001?
The molecular formula of UPCMLD0ENAT5834900:001 is C20H32N6O3.
What is the molecular weight of UPCMLD0ENAT5834900:001?
The molecular weight of UPCMLD0ENAT5834900:001 is 404.25 g/mol.
Where can I buy UPCMLD0ENAT5834900:001?
You can request a quote for UPCMLD0ENAT5834900:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5834900:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5834900:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.