![(E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione structure](/static/products/892/892631-03-7.png)
(E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione
TL;DR: (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione (CAS 892631-03-7) is a chemical compound with molecular formula C18H18N2O6 and molecular weight 358.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-1-butyl-6-hydroxypyrimidine-2,4-dione
Also Known As: (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione, 5-((E)-3-Benzo[1,3]dioxol-5-yl-acryloyl)-3-butyl-6-hydroxy-1H-pyrimidine-2,4-dione, 5-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-1-butyl-6-hydroxypyrimidine-2,4-dione, 5-[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-3-butyl-2,6-dihydroxypyrimidin-4(3H)-one, 5-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-1-butyl-6-hydroxypyrimidine-2,4-dione
| Molecular Formula | C18H18N2O6 |
|---|---|
| Molecular Weight | 358.12 g/mol |
| LogP | 1.6671 |
| Topological Polar Surface Area | 110.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.1165 |
| Heavy Atoms | 26 |
| Complexity | 986.1514 |
Chemical Identifiers
| CAS Number | 892631-03-7 |
|---|---|
| SMILES | CCCCN1C(=C(C(=O)NC1=O)C(=O)/C=C/C2=CC3=C(C=C2)OCO3)O |
Product Overview
(E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione (CAS 892631-03-7), with molecular formula C18H18N2O6 and molecular weight 358.12 g/mol. IUPAC: 5-[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-1-butyl-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione
Property Insights of (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione
The XLogP value of 1.6671 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione. The TPSA of 110.62 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione has 2 hydrogen bond donor(s) and 6 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 (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The CAS number of (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione is 892631-03-7.
What is the molecular formula of (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The molecular formula of (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione is C18H18N2O6.
What is the molecular weight of (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The molecular weight of (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione is 358.12 g/mol.
Where can I buy (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
You can request a quote for (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(3-(benzo[d][1,3]dioxol-5-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.