BAS 01884896
TL;DR: BAS 01884896 (CAS 332923-61-2) is a chemical compound with molecular formula C29H32FNO5S and molecular weight 525.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylsulfanylethyl 7-(3,4-dimethoxyphenyl)-4-(3-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate
Also Known As: BAS 01884896, 2-(ethylsulfanyl)ethyl 7-(3,4-dimethoxyphenyl)-4-(3-fluorophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate, 2-ethylsulfanylethyl 7-(3,4-dimethoxyphenyl)-4-(3-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate, 2-ethylthioethyl 7-(3,4-dimethoxyphenyl)-4-(3-fluorophenyl)-2-methyl-5-oxo-1,4 ,6,7,8-pentahydroquinoline-3-carboxylate
| Molecular Formula | C29H32FNO5S |
|---|---|
| Molecular Weight | 525.20 g/mol |
| LogP | 5.5008 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 525.19855 |
| Heavy Atoms | 37 |
| Complexity | 1254.6082 |
Chemical Identifiers
| CAS Number | 332923-61-2 |
|---|---|
| SMILES | CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)F)C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC)C |
Product Overview
BAS 01884896 (CAS 332923-61-2), with molecular formula C29H32FNO5S and molecular weight 525.20 g/mol. IUPAC: 2-ethylsulfanylethyl 7-(3,4-dimethoxyphenyl)-4-(3-fluorophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate.
Chemical Property Profile of BAS 01884896
Property Insights of BAS 01884896
The XLogP value of 5.5008 indicates that BAS 01884896 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01884896. Following Lipinski's Rule of Five, BAS 01884896 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01884896?
The CAS number of BAS 01884896 is 332923-61-2.
What is the molecular formula of BAS 01884896?
The molecular formula of BAS 01884896 is C29H32FNO5S.
What is the molecular weight of BAS 01884896?
The molecular weight of BAS 01884896 is 525.20 g/mol.
Where can I buy BAS 01884896?
You can request a quote for BAS 01884896 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01884896?
Yes, KEHONG BIO provides custom synthesis services for BAS 01884896 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.