BAS 05884395
TL;DR: BAS 05884395 (CAS 608104-96-7) is a chemical compound with molecular formula C22H25FN2O3S and molecular weight 416.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(diethylamino)propyl]-2-(2-fluorophenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
Also Known As: BAS 05884395, 1-[3-(diethylamino)propyl]-5-(2-fluorophenyl)-3-hydroxy-4-(thiophen-2-ylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one, 1-[3-(diethylamino)propyl]-2-(2-fluorophenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one
| Molecular Formula | C22H25FN2O3S |
|---|---|
| Molecular Weight | 416.16 g/mol |
| LogP | 4.1974 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 416.15698 |
| Heavy Atoms | 29 |
| Complexity | 906.541 |
Chemical Identifiers
| CAS Number | 608104-96-7 |
|---|---|
| SMILES | CCN(CC)CCCN1C(C(=C(C1=O)O)C(=O)C2=CC=CS2)C3=CC=CC=C3F |
Product Overview
BAS 05884395 (CAS 608104-96-7), with molecular formula C22H25FN2O3S and molecular weight 416.16 g/mol. IUPAC: 1-[3-(diethylamino)propyl]-2-(2-fluorophenyl)-4-hydroxy-3-(thiophene-2-carbonyl)-2H-pyrrol-5-one.
Chemical Property Profile of BAS 05884395
Property Insights of BAS 05884395
The XLogP value of 4.1974 indicates that BAS 05884395 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 05884395. Following Lipinski's Rule of Five, BAS 05884395 has 1 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 05884395?
The CAS number of BAS 05884395 is 608104-96-7.
What is the molecular formula of BAS 05884395?
The molecular formula of BAS 05884395 is C22H25FN2O3S.
What is the molecular weight of BAS 05884395?
The molecular weight of BAS 05884395 is 416.16 g/mol.
Where can I buy BAS 05884395?
You can request a quote for BAS 05884395 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 05884395?
Yes, KEHONG BIO provides custom synthesis services for BAS 05884395 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.