UPCMLD0ENAT5732769:001
TL;DR: UPCMLD0ENAT5732769:001 (CAS 893954-02-4) is a chemical compound with molecular formula C19H21N5O5 and molecular weight 399.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[6-(4-ethoxyphenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate
Also Known As: UPCMLD0ENAT5732769:001, methyl 2-[6-(4-ethoxyphenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate, methyl 2-[8-(4-ethoxyphenyl)-1-methyl-2,4-dioxo-1,3,5-trihydroimidazolidino[1, 2-h]purin-3-yl]acetate, methyl [8-(4-ethoxyphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate, methyl 2-(8-(4-ethoxyphenyl)-1-methyl-2,4-dioxo-7,8-dihydro-1H-imidazo[2,1-f]purin-3(2H,4H,6H)-yl)acetate
| Molecular Formula | C19H21N5O5 |
|---|---|
| Molecular Weight | 399.15 g/mol |
| LogP | 0.6201 |
| Topological Polar Surface Area | 100.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.15427 |
| Heavy Atoms | 29 |
| Complexity | 1204.9285 |
Chemical Identifiers
| CAS Number | 893954-02-4 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)OC |
Product Overview
UPCMLD0ENAT5732769:001 (CAS 893954-02-4), with molecular formula C19H21N5O5 and molecular weight 399.15 g/mol. IUPAC: methyl 2-[6-(4-ethoxyphenyl)-4-methyl-1,3-dioxo-7,8-dihydropurino[7,8-a]imidazol-2-yl]acetate.
Chemical Property Profile of UPCMLD0ENAT5732769:001
Property Insights of UPCMLD0ENAT5732769:001
The XLogP value of 0.6201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5732769:001. The TPSA of 100.59 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5732769:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5732769:001 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 UPCMLD0ENAT5732769:001?
The CAS number of UPCMLD0ENAT5732769:001 is 893954-02-4.
What is the molecular formula of UPCMLD0ENAT5732769:001?
The molecular formula of UPCMLD0ENAT5732769:001 is C19H21N5O5.
What is the molecular weight of UPCMLD0ENAT5732769:001?
The molecular weight of UPCMLD0ENAT5732769:001 is 399.15 g/mol.
Where can I buy UPCMLD0ENAT5732769:001?
You can request a quote for UPCMLD0ENAT5732769:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5732769:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5732769:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.