BAS 11099742
TL;DR: BAS 11099742 (CAS 1100706-73-7) is a chemical compound with molecular formula C15H18FNO4S and molecular weight 327.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-thiazolidine-4-carboxylic acid
Also Known As: BAS 11099742, 2-(4-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-thiazolidine-4-carboxylic acid, 3-[(tert-butoxy)carbonyl]-2-(4-fluorophenyl)-1,3-thiazolidine-4-carboxylic acid, 3-[(tert-butyl)oxycarbonyl]-2-(4-fluorophenyl)-1,3-thiazolidine-4-carboxylic a cid, 2-(4-Fluoro-phenyl)-thiazolidine-3,4-dicarboxylic acid 3-tert-butyl ester
| Molecular Formula | C15H18FNO4S |
|---|---|
| Molecular Weight | 327.09 g/mol |
| LogP | 3.2614 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 327.09406 |
| Heavy Atoms | 22 |
| Complexity | 569.9003 |
Chemical Identifiers
| CAS Number | 1100706-73-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1C(CSC1C2=CC=C(C=C2)F)C(=O)O |
Product Overview
BAS 11099742 (CAS 1100706-73-7), with molecular formula C15H18FNO4S and molecular weight 327.09 g/mol. IUPAC: 2-(4-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonyl]-1,3-thiazolidine-4-carboxylic acid.
Chemical Property Profile of BAS 11099742
Property Insights of BAS 11099742
The XLogP value of 3.2614 indicates that BAS 11099742 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11099742. Following Lipinski's Rule of Five, BAS 11099742 has 1 hydrogen bond donor(s) and 4 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 11099742?
The CAS number of BAS 11099742 is 1100706-73-7.
What is the molecular formula of BAS 11099742?
The molecular formula of BAS 11099742 is C15H18FNO4S.
What is the molecular weight of BAS 11099742?
The molecular weight of BAS 11099742 is 327.09 g/mol.
Where can I buy BAS 11099742?
You can request a quote for BAS 11099742 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11099742?
Yes, KEHONG BIO provides custom synthesis services for BAS 11099742 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.