![(5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione structure](/static/products/4237/423736-58-7.webp)
(5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
TL;DR: (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 423736-58-7) is a chemical compound with molecular formula C18H16ClN3O3 and molecular weight 357.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5Z)-5-[[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione
Also Known As: (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione, (5Z)-5-[[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione, (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-6-hydroxy-3-methylpyrimidine-2,4(3H,5H)-dione, (Z)-5-((1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl)methylene)-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C18H16ClN3O3 |
|---|---|
| Molecular Weight | 357.09 g/mol |
| LogP | 2.83914 |
| Topological Polar Surface Area | 71.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 357.088 |
| Heavy Atoms | 25 |
| Complexity | 925.7881 |
Chemical Identifiers
| CAS Number | 423736-58-7 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)Cl)C)/C=C\3/C(=O)NC(=O)N(C3=O)C |
Product Overview
(5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione (CAS 423736-58-7), with molecular formula C18H16ClN3O3 and molecular weight 357.09 g/mol. IUPAC: (5Z)-5-[[1-(4-chlorophenyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1-methyl-1,3-diazinane-2,4,6-trione.
Chemical Property Profile of (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
Property Insights of (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione
The XLogP value of 2.83914 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione. The TPSA of 71.41 Ų falls within the moderate polarity range, balancing permeability and solubility for (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione. Following Lipinski's Rule of Five, (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione has 1 hydrogen bond donor(s) and 3 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-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
The CAS number of (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione is 423736-58-7.
What is the molecular formula of (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular formula of (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione is C18H16ClN3O3.
What is the molecular weight of (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
The molecular weight of (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione is 357.09 g/mol.
Where can I buy (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
You can request a quote for (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione?
Yes, KEHONG BIO provides custom synthesis services for (5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-methylpyrimidine-2,4,6(1H,3H,5H)-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.