BAS 09646336
TL;DR: BAS 09646336 (CAS 726139-83-9) is a chemical compound with molecular formula C21H21NO6 and molecular weight 383.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3-methoxyphenyl)-2-oxoethyl] 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate
Also Known As: BAS 09646336, 2-(3-methoxyphenyl)-2-oxoethyl 1-(4-methoxyphenyl)-5-oxo-3-pyrrolidinecarboxylate, [2-(3-methoxyphenyl)-2-oxoethyl] 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate, 1-(4-Methoxy-phenyl)-5-oxo-pyrrolidine-3-carboxylic acid 2-(3-methoxy-phenyl)-2-oxo-ethyl ester, 2-(3-methoxyphenyl)-2-oxoethyl 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxyl ate
| Molecular Formula | C21H21NO6 |
|---|---|
| Molecular Weight | 383.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 383.1369 |
| Heavy Atoms | 28 |
| Complexity | 571.0 |
Chemical Identifiers
| CAS Number | 726139-83-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)C3=CC(=CC=C3)OC |
| InChIKey | QHODDPDNXLOMOU-UHFFFAOYSA-N |
Product Overview
BAS 09646336 (CAS 726139-83-9), with molecular formula C21H21NO6 and molecular weight 383.14 g/mol. IUPAC: [2-(3-methoxyphenyl)-2-oxoethyl] 1-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxylate.
Chemical Property Profile of BAS 09646336
Property Insights of BAS 09646336
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09646336. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09646336. Following Lipinski's Rule of Five, BAS 09646336 has 0 hydrogen bond donor(s) and 6 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 BAS 09646336?
The CAS number of BAS 09646336 is 726139-83-9.
What is the molecular formula of BAS 09646336?
The molecular formula of BAS 09646336 is C21H21NO6.
What is the molecular weight of BAS 09646336?
The molecular weight of BAS 09646336 is 383.14 g/mol.
Where can I buy BAS 09646336?
You can request a quote for BAS 09646336 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09646336?
Yes, KEHONG BIO provides custom synthesis services for BAS 09646336 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.