![1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione structure](/static/products/577/577989-27-6.png)
1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione
TL;DR: 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione (CAS 577989-27-6) is a chemical compound with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-[C-ethyl-N-(3-hydroxypropyl)carbonimidoyl]-6-hydroxypyrimidine-2,4-dione
Also Known As: 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione, (E)-1-benzyl-5-(1-((3-hydroxypropyl)amino)propylidene)pyrimidine-2,4,6(1H,3H,5H)-trione, (5E)-1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-benzyl-6-hydroxy-5-{1-[(3-hydroxypropyl)amino]propylidene}pyrimidine-2,4(3H,5H)-dione
| Molecular Formula | C17H21N3O4 |
|---|---|
| Molecular Weight | 331.15 g/mol |
| LogP | 0.872 |
| Topological Polar Surface Area | 107.68 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 331.1532 |
| Heavy Atoms | 24 |
| Complexity | 821.96466 |
Chemical Identifiers
| CAS Number | 577989-27-6 |
|---|---|
| SMILES | CCC(=NCCCO)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)O |
Product Overview
1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione (CAS 577989-27-6), with molecular formula C17H21N3O4 and molecular weight 331.15 g/mol. IUPAC: 1-benzyl-5-[C-ethyl-N-(3-hydroxypropyl)carbonimidoyl]-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione
Property Insights of 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione
The XLogP value of 0.872 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione. The TPSA of 107.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione. Following Lipinski's Rule of Five, 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione has 3 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 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione?
The CAS number of 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione is 577989-27-6.
What is the molecular formula of 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione?
The molecular formula of 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione is C17H21N3O4.
What is the molecular weight of 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione?
The molecular weight of 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione is 331.15 g/mol.
Where can I buy 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione?
You can request a quote for 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-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 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione?
Yes, KEHONG BIO provides custom synthesis services for 1-benzyl-5-[1-(3-hydroxypropylamino)propylidene]-1,3-diazinane-2,4,6-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.