(5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
TL;DR: (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione (CAS 1164517-49-0) is a chemical compound with molecular formula C22H19N3O4 and molecular weight 389.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione
Also Known As: (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione, (5Z)-5-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione, (Z)-5-((2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylene)-1-(furan-2-ylmethyl)pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[1-(2,5-Dimethyl-1-phenyl-1H-pyrrol-3-yl)-meth-(Z)-ylidene]-1-furan-2-ylmethyl-pyrimidine-2,4,6-trione
| Molecular Formula | C22H19N3O4 |
|---|---|
| Molecular Weight | 389.14 g/mol |
| LogP | 3.34914 |
| Topological Polar Surface Area | 84.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 389.13754 |
| Heavy Atoms | 29 |
| Complexity | 1124.5312 |
Chemical Identifiers
| CAS Number | 1164517-49-0 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=CC=C2)C)/C=C\3/C(=O)NC(=O)N(C3=O)CC4=CC=CO4 |
Product Overview
(5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione (CAS 1164517-49-0), with molecular formula C22H19N3O4 and molecular weight 389.14 g/mol. IUPAC: (5Z)-5-[(2,5-dimethyl-1-phenylpyrrol-3-yl)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Property Insights of (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
The XLogP value of 3.34914 indicates that (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.55 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione. Following Lipinski's Rule of Five, (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione has 1 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 (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione?
The CAS number of (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione is 1164517-49-0.
What is the molecular formula of (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione?
The molecular formula of (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione is C22H19N3O4.
What is the molecular weight of (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione?
The molecular weight of (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione is 389.14 g/mol.
Where can I buy (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione?
You can request a quote for (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-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 (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-[(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)methylidene]-3-(furan-2-ylmethyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.