UPCMLD0ENAT5712967:001
TL;DR: UPCMLD0ENAT5712967:001 (CAS 847337-76-2) is a chemical compound with molecular formula C21H27N5O4 and molecular weight 413.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione
Also Known As: UPCMLD0ENAT5712967:001, 9-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione, 9-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione, 9-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-1,3,5-trihydro-6H,7H,8H-1,3 -diazaperhydroino[1,2-h]purine-2,4-dione, 9-(4-Ethoxyphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-1,3,5-trihydro-6H,7H,8H-1,3-diazaperhydroino[1,2-h]purine-2,4-dione
| Molecular Formula | C21H27N5O4 |
|---|---|
| Molecular Weight | 413.21 g/mol |
| LogP | 1.7296 |
| Topological Polar Surface Area | 83.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.2063 |
| Heavy Atoms | 30 |
| Complexity | 1175.3005 |
Chemical Identifiers
| CAS Number | 847337-76-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2CC(CN3C2=NC4=C3C(=O)N(C(=O)N4C)CCOC)C |
Product Overview
UPCMLD0ENAT5712967:001 (CAS 847337-76-2), with molecular formula C21H27N5O4 and molecular weight 413.21 g/mol. IUPAC: 9-(4-ethoxyphenyl)-3-(2-methoxyethyl)-1,7-dimethyl-7,8-dihydro-6H-purino[7,8-a]pyrimidine-2,4-dione.
Chemical Property Profile of UPCMLD0ENAT5712967:001
Property Insights of UPCMLD0ENAT5712967:001
The XLogP value of 1.7296 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5712967:001. The TPSA of 83.52 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5712967:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5712967:001 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 UPCMLD0ENAT5712967:001?
The CAS number of UPCMLD0ENAT5712967:001 is 847337-76-2.
What is the molecular formula of UPCMLD0ENAT5712967:001?
The molecular formula of UPCMLD0ENAT5712967:001 is C21H27N5O4.
What is the molecular weight of UPCMLD0ENAT5712967:001?
The molecular weight of UPCMLD0ENAT5712967:001 is 413.21 g/mol.
Where can I buy UPCMLD0ENAT5712967:001?
You can request a quote for UPCMLD0ENAT5712967:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5712967:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5712967:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.