BAS 00489698
TL;DR: BAS 00489698 (CAS 5579-03-3) is a chemical compound with molecular formula C19H16FNO2 and molecular weight 309.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-fluorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid
Also Known As: BAS 00489698, 4-(4-fluorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid, A2031/0085319, 4-(4-Fluoro-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic, 4-(4-fluorophenyl)-3,4,5,3a,9b-pentahydrocyclopenta[1,2-c]quinoline-6-carboxyl ic acid
| Molecular Formula | C19H16FNO2 |
|---|---|
| Molecular Weight | 309.12 g/mol |
| LogP | 4.3504 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.11652 |
| Heavy Atoms | 23 |
| Complexity | 797.51697 |
Chemical Identifiers
| CAS Number | 5579-03-3 |
|---|---|
| SMILES | C1C=CC2C1C(NC3=C2C=CC=C3C(=O)O)C4=CC=C(C=C4)F |
Product Overview
BAS 00489698 (CAS 5579-03-3), with molecular formula C19H16FNO2 and molecular weight 309.12 g/mol. IUPAC: 4-(4-fluorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid.
Chemical Property Profile of BAS 00489698
Property Insights of BAS 00489698
The XLogP value of 4.3504 indicates that BAS 00489698 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.33 Ų, BAS 00489698 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00489698 has 2 hydrogen bond donor(s) and 2 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 00489698?
The CAS number of BAS 00489698 is 5579-03-3.
What is the molecular formula of BAS 00489698?
The molecular formula of BAS 00489698 is C19H16FNO2.
What is the molecular weight of BAS 00489698?
The molecular weight of BAS 00489698 is 309.12 g/mol.
Where can I buy BAS 00489698?
You can request a quote for BAS 00489698 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00489698?
Yes, KEHONG BIO provides custom synthesis services for BAS 00489698 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.