(Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile
TL;DR: (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile (CAS 499114-41-9) is a chemical compound with molecular formula C23H18N4O2 and molecular weight 382.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-[(Z)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzonitrile
Also Known As: (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile, 4-[3-[(Z)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzonitrile, 4-{3-[(Z)-(2-hydroxy-5-oxo-1-phenyl-1,5-dihydro-4H-imidazol-4-ylidene)methyl]-2,5-dimethyl-1H-pyrrol-1-yl}benzonitrile
| Molecular Formula | C23H18N4O2 |
|---|---|
| Molecular Weight | 382.14 g/mol |
| LogP | 4.06312 |
| Topological Polar Surface Area | 78.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 382.14297 |
| Heavy Atoms | 29 |
| Complexity | 1182.111 |
Chemical Identifiers
| CAS Number | 499114-41-9 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)C#N)C)/C=C\3/C(=O)N(C(=O)N3)C4=CC=CC=C4 |
Product Overview
(Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile (CAS 499114-41-9), with molecular formula C23H18N4O2 and molecular weight 382.14 g/mol. IUPAC: 4-[3-[(Z)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-2,5-dimethylpyrrol-1-yl]benzonitrile.
Chemical Property Profile of (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile
Property Insights of (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile
The XLogP value of 4.06312 indicates that (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.13 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile. Following Lipinski's Rule of Five, (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile 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 (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile?
The CAS number of (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile is 499114-41-9.
What is the molecular formula of (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile?
The molecular formula of (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile is C23H18N4O2.
What is the molecular weight of (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile?
The molecular weight of (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile is 382.14 g/mol.
Where can I buy (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile?
You can request a quote for (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-(3-((2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.