BAS 09535829
TL;DR: BAS 09535829 (CAS 710972-82-0) is a chemical compound with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-(4-methylphenyl)pyrrolidin-2-one
Also Known As: BAS 09535829, 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-(4-methylphenyl)pyrrolidin-2-one, 4-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl}-1-(4-methylphenyl)pyrrolidin-2-one, 4-(4-Benzo[1,3]dioxol-5-ylmethyl-piperazine-1-carbonyl)-1-p-tolyl-pyrrolidin-2-one, 4-(4-piperonylpiperazine-1-carbonyl)-1-(p-tolyl)-2-pyrrolidone
| Molecular Formula | C24H27N3O4 |
|---|---|
| Molecular Weight | 421.20 g/mol |
| LogP | 2.42102 |
| Topological Polar Surface Area | 62.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.20016 |
| Heavy Atoms | 31 |
| Complexity | 982.819 |
Chemical Identifiers
| CAS Number | 710972-82-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5 |
Product Overview
BAS 09535829 (CAS 710972-82-0), with molecular formula C24H27N3O4 and molecular weight 421.20 g/mol. IUPAC: 4-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-1-(4-methylphenyl)pyrrolidin-2-one.
Chemical Property Profile of BAS 09535829
Property Insights of BAS 09535829
The XLogP value of 2.42102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 09535829. The TPSA of 62.32 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 09535829. Following Lipinski's Rule of Five, BAS 09535829 has 0 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 BAS 09535829?
The CAS number of BAS 09535829 is 710972-82-0.
What is the molecular formula of BAS 09535829?
The molecular formula of BAS 09535829 is C24H27N3O4.
What is the molecular weight of BAS 09535829?
The molecular weight of BAS 09535829 is 421.20 g/mol.
Where can I buy BAS 09535829?
You can request a quote for BAS 09535829 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 09535829?
Yes, KEHONG BIO provides custom synthesis services for BAS 09535829 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.