(5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
TL;DR: (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione (CAS 1164556-79-9) is a chemical compound with molecular formula C19H25N3O3 and molecular weight 343.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-(N-hexyl-C-methylcarbonimidoyl)-6-hydroxypyrimidine-2,4-dione
Also Known As: 1-benzyl-5-[1-(hexylamino)ethylidene]-1,3-diazinane-2,4,6-trione, 1-Benzyl-5-[1-hexylamino-eth-(E)-ylidene]-pyrimidine-2,4,6-trione, (5E)-1-benzyl-5-[1-(hexylamino)ethylidene]-1,3-diazinane-2,4,6-trione, (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione, (E)-1-benzyl-5-(1-(hexylamino)ethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C19H25N3O3 |
|---|---|
| Molecular Weight | 343.19 g/mol |
| LogP | 2.6798 |
| Topological Polar Surface Area | 87.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 343.1896 |
| Heavy Atoms | 25 |
| Complexity | 835.2282 |
Chemical Identifiers
| CAS Number | 1164556-79-9 |
|---|---|
| SMILES | CCCCCCN=C(C)C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)O |
Product Overview
(5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione (CAS 1164556-79-9), with molecular formula C19H25N3O3 and molecular weight 343.19 g/mol. IUPAC: 1-benzyl-5-(N-hexyl-C-methylcarbonimidoyl)-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
Property Insights of (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione
The XLogP value of 2.6798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione. The TPSA of 87.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione has 2 hydrogen bond donor(s) and 4 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)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione?
The CAS number of (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione is 1164556-79-9.
What is the molecular formula of (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione?
The molecular formula of (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione is C19H25N3O3.
What is the molecular weight of (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione?
The molecular weight of (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione is 343.19 g/mol.
Where can I buy (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione?
You can request a quote for (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (5E)-3-benzyl-5-[1-(hexylamino)ethylidene]-6-hydroxypyrimidine-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.