BAS 04379287
TL;DR: BAS 04379287 (CAS 421574-52-9) is a chemical compound with molecular formula C26H26FNO3S and molecular weight 451.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopentyl 4-(3-fluorophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 04379287, A2774/0117482, cyclopentyl 4-(3-fluorophenyl)-2-methyl-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate, cyclopentyl 4-(3-fluorophenyl)-2-methyl-5-oxo-7-(2-thienyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, cyclopentyl 4-(3-fluorophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
| Molecular Formula | C26H26FNO3S |
|---|---|
| Molecular Weight | 451.16 g/mol |
| LogP | 5.7346 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 451.16174 |
| Heavy Atoms | 32 |
| Complexity | 1111.8516 |
Chemical Identifiers
| CAS Number | 421574-52-9 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CC(CC2=O)C3=CC=CS3)C4=CC(=CC=C4)F)C(=O)OC5CCCC5 |
Product Overview
BAS 04379287 (CAS 421574-52-9), with molecular formula C26H26FNO3S and molecular weight 451.16 g/mol. IUPAC: cyclopentyl 4-(3-fluorophenyl)-2-methyl-5-oxo-7-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 04379287
Property Insights of BAS 04379287
The XLogP value of 5.7346 indicates that BAS 04379287 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, BAS 04379287 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04379287 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 04379287?
The CAS number of BAS 04379287 is 421574-52-9.
What is the molecular formula of BAS 04379287?
The molecular formula of BAS 04379287 is C26H26FNO3S.
What is the molecular weight of BAS 04379287?
The molecular weight of BAS 04379287 is 451.16 g/mol.
Where can I buy BAS 04379287?
You can request a quote for BAS 04379287 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04379287?
Yes, KEHONG BIO provides custom synthesis services for BAS 04379287 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.