Integrin Antagonists 27
TL;DR: Integrin Antagonists 27 (CAS 593274-97-6) is a chemical compound with molecular formula C24H20N4O5 and molecular weight 444.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-[[1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]pyrrol-1-yl]benzoic acid
Also Known As: Integrin Antagonists 27, Integrin-IN-27, 3-(2-{[(4E)-1-{[(4-METHYLPHENYL)CARBAMOYL]METHYL}-2,5-DIOXOIMIDAZOLIDIN-4-YLIDENE]METHYL}PYRROL-1-YL)BENZOIC ACID, 3-[2-[[1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxo-4-imidazolidinylidene]methyl]-1-pyrrolyl]benzoic acid, 3-[2-[[1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]pyrrol-1-yl]benzoic acid
| Molecular Formula | C24H20N4O5 |
|---|---|
| Molecular Weight | 444.14 g/mol |
| LogP | 3.01532 |
| Topological Polar Surface Area | 120.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.14337 |
| Heavy Atoms | 33 |
| Complexity | 1290.1932 |
Chemical Identifiers
| CAS Number | 593274-97-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC=CN3C4=CC=CC(=C4)C(=O)O)NC2=O |
Product Overview
Integrin Antagonists 27 (CAS 593274-97-6), with molecular formula C24H20N4O5 and molecular weight 444.14 g/mol. IUPAC: 3-[2-[[1-[2-(4-methylanilino)-2-oxoethyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]pyrrol-1-yl]benzoic acid.
Chemical Property Profile of Integrin Antagonists 27
Property Insights of Integrin Antagonists 27
The XLogP value of 3.01532 indicates that Integrin Antagonists 27 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Integrin Antagonists 27. Following Lipinski's Rule of Five, Integrin Antagonists 27 has 3 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 Integrin Antagonists 27?
The CAS number of Integrin Antagonists 27 is 593274-97-6.
What is the molecular formula of Integrin Antagonists 27?
The molecular formula of Integrin Antagonists 27 is C24H20N4O5.
What is the molecular weight of Integrin Antagonists 27?
The molecular weight of Integrin Antagonists 27 is 444.14 g/mol.
Where can I buy Integrin Antagonists 27?
You can request a quote for Integrin Antagonists 27 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Integrin Antagonists 27?
Yes, KEHONG BIO provides custom synthesis services for Integrin Antagonists 27 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.