AB00738366-01
TL;DR: AB00738366-01 (CAS 808159-80-0) is a chemical compound with molecular formula C20H16ClFN2O3 and molecular weight 386.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-chloropyridine-3-carboxylate
Also Known As: AB00738366-01, [2-[1-(4-fluorophenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl] 2-chloropyridine-3-carboxylate, [2-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-chloropyridine-3-carboxylate, 2-[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-2-oxoethyl 2-chloropyridine-3-carboxylate
| Molecular Formula | C20H16ClFN2O3 |
|---|---|
| Molecular Weight | 386.08 g/mol |
| LogP | 4.32134 |
| Topological Polar Surface Area | 61.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 386.08334 |
| Heavy Atoms | 27 |
| Complexity | 1012.56635 |
Chemical Identifiers
| CAS Number | 808159-80-0 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)COC(=O)C3=C(N=CC=C3)Cl |
Product Overview
AB00738366-01 (CAS 808159-80-0), with molecular formula C20H16ClFN2O3 and molecular weight 386.08 g/mol. IUPAC: [2-[1-(4-fluorophenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] 2-chloropyridine-3-carboxylate.
Chemical Property Profile of AB00738366-01
Property Insights of AB00738366-01
The XLogP value of 4.32134 indicates that AB00738366-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.19 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00738366-01. Following Lipinski's Rule of Five, AB00738366-01 has 0 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 AB00738366-01?
The CAS number of AB00738366-01 is 808159-80-0.
What is the molecular formula of AB00738366-01?
The molecular formula of AB00738366-01 is C20H16ClFN2O3.
What is the molecular weight of AB00738366-01?
The molecular weight of AB00738366-01 is 386.08 g/mol.
Where can I buy AB00738366-01?
You can request a quote for AB00738366-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00738366-01?
Yes, KEHONG BIO provides custom synthesis services for AB00738366-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.