![(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/716/716331-98-5.png)
(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione (CAS 716331-98-5) is a chemical compound with molecular formula C28H29N3O5 and molecular weight 487.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione, (5Z)-3-[2-(3,4-dimethoxyphenyl)ethyl]-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-6-hydroxypyrimidine-2,4(3H,5H)-dione, (Z)-1-(3,4-dimethoxyphenethyl)-5-((2,5-dimethyl-1-(p-tolyl)-1H-pyrrol-3-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C28H29N3O5 |
|---|---|
| Molecular Weight | 487.21 g/mol |
| LogP | 4.12426 |
| Topological Polar Surface Area | 89.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 487.21072 |
| Heavy Atoms | 36 |
| Complexity | 1368.5671 |
Chemical Identifiers
| CAS Number | 716331-98-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=CC(=C2C)/C=C\3/C(=O)NC(=O)N(C3=O)CCC4=CC(=C(C=C4)OC)OC)C |
Product Overview
(5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione (CAS 716331-98-5), with molecular formula C28H29N3O5 and molecular weight 487.21 g/mol. IUPAC: (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 4.12426 indicates that (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.87 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione 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 (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is 716331-98-5.
What is the molecular formula of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is C28H29N3O5.
What is the molecular weight of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione is 487.21 g/mol.
Where can I buy (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-1-[2-(3,4-dimethoxyphenyl)ethyl]-5-[[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.