AH-487/41661053
TL;DR: AH-487/41661053 (CAS 1815599-46-2) is a chemical compound with molecular formula C21H14ClN3O4 and molecular weight 407.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[(E)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl]pyrrol-1-yl]benzoic acid
Also Known As: AH-487/41661053, 4-(2-{[1-(3-chlorophenyl)-2,5-dioxo-4-imidazolidinylidene]methyl}-1H-pyrrol-1-yl)benzoic acid, 4-[2-[(E)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl]pyrrol-1-yl]benzoic acid, (E)-4-(2-((1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene)methyl)-1H-pyrrol-1-yl)benzoic acid, 4-(2-{(E)-[1-(3-chlorophenyl)-2-hydroxy-5-oxo-1,5-dihydro-4H-imidazol-4-ylidene]methyl}-1H-pyrrol-1-yl)benzoic acid
| Molecular Formula | C21H14ClN3O4 |
|---|---|
| Molecular Weight | 407.07 g/mol |
| LogP | 3.9262 |
| Topological Polar Surface Area | 91.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.0673 |
| Heavy Atoms | 29 |
| Complexity | 1164.6791 |
Chemical Identifiers
| CAS Number | 1815599-46-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)N2C(=O)/C(=C\C3=CC=CN3C4=CC=C(C=C4)C(=O)O)/NC2=O |
Product Overview
AH-487/41661053 (CAS 1815599-46-2), with molecular formula C21H14ClN3O4 and molecular weight 407.07 g/mol. IUPAC: 4-[2-[(E)-[1-(3-chlorophenyl)-2,5-dioxoimidazolidin-4-ylidene]methyl]pyrrol-1-yl]benzoic acid.
Chemical Property Profile of AH-487/41661053
Property Insights of AH-487/41661053
The XLogP value of 3.9262 indicates that AH-487/41661053 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.64 Ų falls within the moderate polarity range, balancing permeability and solubility for AH-487/41661053. Following Lipinski's Rule of Five, AH-487/41661053 has 2 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 AH-487/41661053?
The CAS number of AH-487/41661053 is 1815599-46-2.
What is the molecular formula of AH-487/41661053?
The molecular formula of AH-487/41661053 is C21H14ClN3O4.
What is the molecular weight of AH-487/41661053?
The molecular weight of AH-487/41661053 is 407.07 g/mol.
Where can I buy AH-487/41661053?
You can request a quote for AH-487/41661053 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/41661053?
Yes, KEHONG BIO provides custom synthesis services for AH-487/41661053 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.