BAS 06486231
TL;DR: BAS 06486231 (CAS 619271-40-8) is a chemical compound with molecular formula C22H26N2O4S and molecular weight 414.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(dimethylamino)propyl]-2-(3-ethoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: BAS 06486231, 1-[3-(dimethylamino)propyl]-5-(3-ethoxyphenyl)-3-hydroxy-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, 1-[3-(dimethylamino)propyl]-2-(3-ethoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
| Molecular Formula | C22H26N2O4S |
|---|---|
| Molecular Weight | 414.16 g/mol |
| LogP | 3.6768 |
| Topological Polar Surface Area | 70.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 414.16132 |
| Heavy Atoms | 29 |
| Complexity | 905.2959 |
Chemical Identifiers
| CAS Number | 619271-40-8 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCCN(C)C)O)C(=O)C3=CC=CS3 |
Product Overview
BAS 06486231 (CAS 619271-40-8), with molecular formula C22H26N2O4S and molecular weight 414.16 g/mol. IUPAC: 1-[3-(dimethylamino)propyl]-2-(3-ethoxyphenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of BAS 06486231
Property Insights of BAS 06486231
The XLogP value of 3.6768 indicates that BAS 06486231 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06486231. Following Lipinski's Rule of Five, BAS 06486231 has 1 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 06486231?
The CAS number of BAS 06486231 is 619271-40-8.
What is the molecular formula of BAS 06486231?
The molecular formula of BAS 06486231 is C22H26N2O4S.
What is the molecular weight of BAS 06486231?
The molecular weight of BAS 06486231 is 414.16 g/mol.
Where can I buy BAS 06486231?
You can request a quote for BAS 06486231 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06486231?
Yes, KEHONG BIO provides custom synthesis services for BAS 06486231 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.