(5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
TL;DR: (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione (CAS 714232-19-6) is a chemical compound with molecular formula C18H14BrN3O4 and molecular weight 415.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-bromophenyl)iminomethyl]-6-hydroxy-1-(4-methoxyphenyl)pyrimidine-2,4-dione
Also Known As: (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione, 5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione, (5Z)-5-{[(2-bromophenyl)amino]methylidene}-6-hydroxy-3-(4-methoxyphenyl)pyrimidine-2,4(3H,5H)-dione, (Z)-5-(((2-bromophenyl)amino)methylene)-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C18H14BrN3O4 |
|---|---|
| Molecular Weight | 415.02 g/mol |
| LogP | 2.7531 |
| Topological Polar Surface Area | 96.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.01678 |
| Heavy Atoms | 26 |
| Complexity | 1084.8257 |
Chemical Identifiers
| CAS Number | 714232-19-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C=NC3=CC=CC=C3Br)O |
Product Overview
(5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione (CAS 714232-19-6), with molecular formula C18H14BrN3O4 and molecular weight 415.02 g/mol. IUPAC: 5-[(2-bromophenyl)iminomethyl]-6-hydroxy-1-(4-methoxyphenyl)pyrimidine-2,4-dione.
Chemical Property Profile of (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
Property Insights of (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione
The XLogP value of 2.7531 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione. The TPSA of 96.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione has 2 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 (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione?
The CAS number of (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione is 714232-19-6.
What is the molecular formula of (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione?
The molecular formula of (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione is C18H14BrN3O4.
What is the molecular weight of (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione?
The molecular weight of (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione is 415.02 g/mol.
Where can I buy (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione?
You can request a quote for (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-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-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-5-[(2-bromoanilino)methylidene]-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.