![(5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/373/373376-94-4.png)
(5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
TL;DR: (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione (CAS 373376-94-4) is a chemical compound with molecular formula C17H13N3O6S and molecular weight 387.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Also Known As: (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione, (Z)-1-(4-methoxybenzyl)-5-((5-nitrothiophen-2-yl)methylene)pyrimidine-2,4,6(1H,3H,5H)-trione, 1-(4-Methoxy-benzyl)-5-[1-(5-nitro-thiophen-2-yl)-meth-(Z)-ylidene]-pyrimidine-2,4,6-trione
| Molecular Formula | C17H13N3O6S |
|---|---|
| Molecular Weight | 387.05 g/mol |
| LogP | 2.3269 |
| Topological Polar Surface Area | 118.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.05252 |
| Heavy Atoms | 27 |
| Complexity | 963.3033 |
Chemical Identifiers
| CAS Number | 373376-94-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CN2C(=O)/C(=C\C3=CC=C(S3)[N+](=O)[O-])/C(=O)NC2=O |
Product Overview
(5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione (CAS 373376-94-4), with molecular formula C17H13N3O6S and molecular weight 387.05 g/mol. IUPAC: (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
Property Insights of (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 2.3269 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 118.85 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione has 1 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 (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione is 373376-94-4.
What is the molecular formula of (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione is C17H13N3O6S.
What is the molecular weight of (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione is 387.05 g/mol.
Where can I buy (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-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-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-1-[(4-methoxyphenyl)methyl]-5-[(5-nitrothiophen-2-yl)methylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.