BAS 00822743
TL;DR: BAS 00822743 (CAS 340746-30-7) is a chemical compound with molecular formula C18H21FN2O3 and molecular weight 332.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-ethyl-6-fluoro-4-oxo-7-pyrrolidin-1-ylquinoline-3-carboxylate
Also Known As: BAS 00822743, ethyl 1-ethyl-6-fluoro-4-oxo-7-(pyrrolidin-1-yl)-1,4-dihydroquinoline-3-carboxylate, ethyl 1-ethyl-6-fluoro-4-oxo-7-pyrrolidin-1-ylquinoline-3-carboxylate, ethyl 1-ethyl-6-fluoro-4-oxo-7-(1-pyrrolidinyl)-1,4-dihydro-3-quinolinecarboxylate, 1-Ethyl-6-fluoro-4-oxo-7-pyrrolidin-1-yl-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester
| Molecular Formula | C18H21FN2O3 |
|---|---|
| Molecular Weight | 332.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 49.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.15363 |
| Heavy Atoms | 24 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 340746-30-7 |
|---|---|
| SMILES | CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCCC3)F)C(=O)OCC |
| InChIKey | GFGLTLIUNOGPRL-UHFFFAOYSA-N |
Product Overview
BAS 00822743 (CAS 340746-30-7), with molecular formula C18H21FN2O3 and molecular weight 332.15 g/mol. IUPAC: ethyl 1-ethyl-6-fluoro-4-oxo-7-pyrrolidin-1-ylquinoline-3-carboxylate.
Chemical Property Profile of BAS 00822743
Property Insights of BAS 00822743
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00822743. With a topological polar surface area (TPSA) of 49.9 Ų, BAS 00822743 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 00822743 has 0 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 00822743?
The CAS number of BAS 00822743 is 340746-30-7.
What is the molecular formula of BAS 00822743?
The molecular formula of BAS 00822743 is C18H21FN2O3.
What is the molecular weight of BAS 00822743?
The molecular weight of BAS 00822743 is 332.15 g/mol.
Where can I buy BAS 00822743?
You can request a quote for BAS 00822743 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00822743?
Yes, KEHONG BIO provides custom synthesis services for BAS 00822743 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.