![(5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione structure](/static/products/328/328068-51-5.png)
(5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione (CAS 328068-51-5) is a chemical compound with molecular formula C18H13N5O3S and molecular weight 379.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2,1,3-benzothiadiazol-4-yliminomethyl)-6-hydroxy-1-(2-methylphenyl)pyrimidine-2,4-dione
Also Known As: (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-6-hydroxy-3-(2-methylphenyl)pyrimidine-2,4(3H,5H)-dione, (E)-5-((benzo[c][1,2,5]thiadiazol-4-ylamino)methylene)-1-(o-tolyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione
| Molecular Formula | C18H13N5O3S |
|---|---|
| Molecular Weight | 379.07 g/mol |
| LogP | 2.29512 |
| Topological Polar Surface Area | 113.23 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.0739 |
| Heavy Atoms | 27 |
| Complexity | 1302.3389 |
Chemical Identifiers
| CAS Number | 328068-51-5 |
|---|---|
| SMILES | CC1=CC=CC=C1N2C(=C(C(=O)NC2=O)C=NC3=CC=CC4=NSN=C43)O |
Product Overview
(5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione (CAS 328068-51-5), with molecular formula C18H13N5O3S and molecular weight 379.07 g/mol. IUPAC: 5-(2,1,3-benzothiadiazol-4-yliminomethyl)-6-hydroxy-1-(2-methylphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 2.29512 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione. The TPSA of 113.23 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione 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)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione is 328068-51-5.
What is the molecular formula of (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione is C18H13N5O3S.
What is the molecular weight of (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione is 379.07 g/mol.
Where can I buy (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-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 (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[(2,1,3-benzothiadiazol-4-ylamino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.