UPCMLD0ENAT5830767:001
TL;DR: UPCMLD0ENAT5830767:001 (CAS 878432-71-4) is a chemical compound with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-methoxyethyl)-3-methyl-8-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]purine-2,6-dione
Also Known As: UPCMLD0ENAT5830767:001, 7-(2-methoxyethyl)-3-methyl-8-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]purine-2,6-dione, 7-(2-methoxyethyl)-3-methyl-8-[4-[(Z)-3-phenylprop-2-enyl]piperazin-1-yl]purine-2,6-dione
| Molecular Formula | C22H28N6O3 |
|---|---|
| Molecular Weight | 424.22 g/mol |
| LogP | 0.9051 |
| Topological Polar Surface Area | 88.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.2223 |
| Heavy Atoms | 31 |
| Complexity | 1169.6598 |
Chemical Identifiers
| CAS Number | 878432-71-4 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCN(CC3)C/C=C/C4=CC=CC=C4)CCOC |
Product Overview
UPCMLD0ENAT5830767:001 (CAS 878432-71-4), with molecular formula C22H28N6O3 and molecular weight 424.22 g/mol. IUPAC: 7-(2-methoxyethyl)-3-methyl-8-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]purine-2,6-dione.
Chemical Property Profile of UPCMLD0ENAT5830767:001
Property Insights of UPCMLD0ENAT5830767:001
The XLogP value of 0.9051 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5830767:001. The TPSA of 88.39 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5830767:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5830767:001 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 UPCMLD0ENAT5830767:001?
The CAS number of UPCMLD0ENAT5830767:001 is 878432-71-4.
What is the molecular formula of UPCMLD0ENAT5830767:001?
The molecular formula of UPCMLD0ENAT5830767:001 is C22H28N6O3.
What is the molecular weight of UPCMLD0ENAT5830767:001?
The molecular weight of UPCMLD0ENAT5830767:001 is 424.22 g/mol.
Where can I buy UPCMLD0ENAT5830767:001?
You can request a quote for UPCMLD0ENAT5830767:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5830767:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5830767:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.