BAS 01306530
TL;DR: BAS 01306530 (CAS 135038-38-9) is a chemical compound with molecular formula C21H20FN3O5 and molecular weight 413.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid
Also Known As: BAS 01306530, 1-ethyl-6-fluoro-7-(4-(furan-2-carbonyl)piperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid, 1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid, 1-ethyl-6-fluoro-7-[4-(2-furoyl)-1-piperazinyl]-4-oxo-1,4-dihydro-3-quinolinecarboxylic acid
| Molecular Formula | C21H20FN3O5 |
|---|---|
| Molecular Weight | 413.14 g/mol |
| LogP | 2.4141 |
| Topological Polar Surface Area | 95.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.1387 |
| Heavy Atoms | 30 |
| Complexity | 1177.5603 |
Chemical Identifiers
| CAS Number | 135038-38-9 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C(=O)C4=CC=CO4)F)C(=O)O |
Product Overview
BAS 01306530 (CAS 135038-38-9), with molecular formula C21H20FN3O5 and molecular weight 413.14 g/mol. IUPAC: 1-ethyl-6-fluoro-7-[4-(furan-2-carbonyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid.
Chemical Property Profile of BAS 01306530
Property Insights of BAS 01306530
The XLogP value of 2.4141 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 01306530. The TPSA of 95.99 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01306530. Following Lipinski's Rule of Five, BAS 01306530 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 01306530?
The CAS number of BAS 01306530 is 135038-38-9.
What is the molecular formula of BAS 01306530?
The molecular formula of BAS 01306530 is C21H20FN3O5.
What is the molecular weight of BAS 01306530?
The molecular weight of BAS 01306530 is 413.14 g/mol.
Where can I buy BAS 01306530?
You can request a quote for BAS 01306530 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01306530?
Yes, KEHONG BIO provides custom synthesis services for BAS 01306530 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.