AB00116515-01
TL;DR: AB00116515-01 (CAS 431920-80-8) is a chemical compound with molecular formula C21H20ClN3O5 and molecular weight 429.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[(Z)-[1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-2-ethoxyphenoxy]acetamide
Also Known As: AB00116515-01, 2-(4-{(Z)-[1-(4-chlorobenzyl)-2,5-dioxoimidazolidin-4-ylidene]methyl}-2-ethoxyphenoxy)acetamide, 2-[4-[(Z)-[1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-2-ethoxyphenoxy]acetamide, 2-(4-{[(4Z)-1-[(4-CHLOROPHENYL)METHYL]-2,5-DIOXOIMIDAZOLIDIN-4-YLIDENE]METHYL}-2-ETHOXYPHENOXY)ACETAMIDE, 2-(4-{[1-(4-chlorobenzyl)-2,5-dioxo-4-imidazolidinylidene]methyl}-2-ethoxyphenoxy)acetamide
| Molecular Formula | C21H20ClN3O5 |
|---|---|
| Molecular Weight | 429.11 g/mol |
| LogP | 2.6957 |
| Topological Polar Surface Area | 110.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 429.10916 |
| Heavy Atoms | 30 |
| Complexity | 1004.2015 |
Chemical Identifiers
| CAS Number | 431920-80-8 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N(C(=O)N2)CC3=CC=C(C=C3)Cl)OCC(=O)N |
Product Overview
AB00116515-01 (CAS 431920-80-8), with molecular formula C21H20ClN3O5 and molecular weight 429.11 g/mol. IUPAC: 2-[4-[(Z)-[1-[(4-chlorophenyl)methyl]-2,5-dioxoimidazolidin-4-ylidene]methyl]-2-ethoxyphenoxy]acetamide.
Chemical Property Profile of AB00116515-01
Property Insights of AB00116515-01
The XLogP value of 2.6957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00116515-01. The TPSA of 110.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00116515-01. Following Lipinski's Rule of Five, AB00116515-01 has 2 hydrogen bond donor(s) and 5 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 AB00116515-01?
The CAS number of AB00116515-01 is 431920-80-8.
What is the molecular formula of AB00116515-01?
The molecular formula of AB00116515-01 is C21H20ClN3O5.
What is the molecular weight of AB00116515-01?
The molecular weight of AB00116515-01 is 429.11 g/mol.
Where can I buy AB00116515-01?
You can request a quote for AB00116515-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00116515-01?
Yes, KEHONG BIO provides custom synthesis services for AB00116515-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.