(E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione
TL;DR: (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione (CAS 892613-73-9) is a chemical compound with molecular formula C26H25N3O4 and molecular weight 443.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(E)-3-(1-benzylindol-3-yl)prop-2-enoyl]-1-butyl-6-hydroxypyrimidine-2,4-dione
Also Known As: (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione, 5-[(E)-3-(1-benzylindol-3-yl)prop-2-enoyl]-1-butyl-6-hydroxypyrimidine-2,4-dione, 5-[(2E)-3-(1-benzyl-1H-indol-3-yl)prop-2-enoyl]-3-butyl-2,6-dihydroxypyrimidin-4(3H)-one
| Molecular Formula | C26H25N3O4 |
|---|---|
| Molecular Weight | 443.18 g/mol |
| LogP | 3.9414 |
| Topological Polar Surface Area | 97.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 443.1845 |
| Heavy Atoms | 33 |
| Complexity | 1442.1663 |
Chemical Identifiers
| CAS Number | 892613-73-9 |
|---|---|
| SMILES | CCCCN1C(=C(C(=O)NC1=O)C(=O)/C=C/C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)O |
Product Overview
(E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione (CAS 892613-73-9), with molecular formula C26H25N3O4 and molecular weight 443.18 g/mol. IUPAC: 5-[(E)-3-(1-benzylindol-3-yl)prop-2-enoyl]-1-butyl-6-hydroxypyrimidine-2,4-dione.
Chemical Property Profile of (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione
Property Insights of (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione
The XLogP value of 3.9414 indicates that (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.09 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione. Following Lipinski's Rule of Five, (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-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 (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The CAS number of (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione is 892613-73-9.
What is the molecular formula of (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The molecular formula of (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione is C26H25N3O4.
What is the molecular weight of (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
The molecular weight of (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione is 443.18 g/mol.
Where can I buy (E)-5-(3-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
You can request a quote for (E)-5-(3-(1-benzyl-1H-indol-3-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-(1-benzyl-1H-indol-3-yl)acryloyl)-3-butyl-6-hydroxypyrimidine-2,4(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-(3-(1-benzyl-1H-indol-3-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.