BAS 01317535
TL;DR: BAS 01317535 (CAS 5988-74-9) is a chemical compound with molecular formula C21H21NO4 and molecular weight 351.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-[(4-methylphenyl)methyl]pyrrolidine-2,5-dione
Also Known As: BAS 01317535, 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-methylbenzyl)-2,5-pyrrolidinedione, 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-[(4-methylphenyl)methyl]pyrrolidine-2,5-dione, 1-[2-(2H-1,3-Benzodioxol-5-yl)ethyl]-3-[(4-methylphenyl)methyl]pyrrolidine-2,5-dione, 1-(2-Benzo[1,3]dioxol-5-yl-ethyl)-3-(4-methyl-benzyl)-pyrrolidine-2,5-dione
| Molecular Formula | C21H21NO4 |
|---|---|
| Molecular Weight | 351.15 g/mol |
| LogP | 2.88402 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.14706 |
| Heavy Atoms | 26 |
| Complexity | 843.5896 |
Chemical Identifiers
| CAS Number | 5988-74-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC2CC(=O)N(C2=O)CCC3=CC4=C(C=C3)OCO4 |
Product Overview
BAS 01317535 (CAS 5988-74-9), with molecular formula C21H21NO4 and molecular weight 351.15 g/mol. IUPAC: 1-[2-(1,3-benzodioxol-5-yl)ethyl]-3-[(4-methylphenyl)methyl]pyrrolidine-2,5-dione.
Chemical Property Profile of BAS 01317535
Property Insights of BAS 01317535
The XLogP value of 2.88402 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01317535. With a topological polar surface area (TPSA) of 55.84 Ų, BAS 01317535 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 01317535 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 BAS 01317535?
The CAS number of BAS 01317535 is 5988-74-9.
What is the molecular formula of BAS 01317535?
The molecular formula of BAS 01317535 is C21H21NO4.
What is the molecular weight of BAS 01317535?
The molecular weight of BAS 01317535 is 351.15 g/mol.
Where can I buy BAS 01317535?
You can request a quote for BAS 01317535 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01317535?
Yes, KEHONG BIO provides custom synthesis services for BAS 01317535 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.