![(5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione structure](/static/products/714/714253-80-2.png)
(5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
TL;DR: (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione (CAS 714253-80-2) is a chemical compound with molecular formula C20H25N3O6 and molecular weight 403.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-(oxolan-2-ylmethyliminomethyl)pyrimidine-2,4-dione
Also Known As: (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione, (E)-1-(3,4-dimethoxyphenethyl)-5-((((tetrahydrofuran-2-yl)methyl)amino)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[(oxolan-2-ylmethylamino)methylidene]-1,3-diazinane-2,4,6-trione
| Molecular Formula | C20H25N3O6 |
|---|---|
| Molecular Weight | 403.17 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 115.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 403.17435 |
| Heavy Atoms | 29 |
| Complexity | 988.68665 |
Chemical Identifiers
| CAS Number | 714253-80-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2C(=C(C(=O)NC2=O)C=NCC3CCCO3)O)OC |
Product Overview
(5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione (CAS 714253-80-2), with molecular formula C20H25N3O6 and molecular weight 403.17 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-(oxolan-2-ylmethyliminomethyl)pyrimidine-2,4-dione.
Chemical Property Profile of (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
Property Insights of (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione. The TPSA of 115.14 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione has 2 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 (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione?
The CAS number of (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione is 714253-80-2.
What is the molecular formula of (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione?
The molecular formula of (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione is C20H25N3O6.
What is the molecular weight of (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione?
The molecular weight of (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione is 403.17 g/mol.
Where can I buy (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione?
You can request a quote for (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-3-[2-(3,4-dimethoxyphenyl)ethyl]-6-hydroxy-5-{[(tetrahydrofuran-2-ylmethyl)amino]methylidene}pyrimidine-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.