TimTec1_006781
TL;DR: TimTec1_006781 (CAS 371946-43-9) is a chemical compound with molecular formula C15H22N2O4S and molecular weight 326.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(2-amino-1,3-thiazol-4-yl)-3-butyl-5-methyl-2-oxooxolane-3-carboxylate
Also Known As: TimTec1_006781, BAS 02789587, AL-281/36996013, ethyl 5-(2-amino-1,3-thiazol-4-yl)-3-butyl-5-methyl-2-oxotetrahydro-3-furancarboxylate, ethyl 5-(2-amino-1,3-thiazol-4-yl)-3-butyl-5-methyl-2-oxooxolane-3-carboxylate
| Molecular Formula | C15H22N2O4S |
|---|---|
| Molecular Weight | 326.13 g/mol |
| LogP | 2.6271 |
| Topological Polar Surface Area | 91.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.13004 |
| Heavy Atoms | 22 |
| Complexity | 573.6436 |
Chemical Identifiers
| CAS Number | 371946-43-9 |
|---|---|
| SMILES | CCCCC1(CC(OC1=O)(C)C2=CSC(=N2)N)C(=O)OCC |
Product Overview
TimTec1_006781 (CAS 371946-43-9), with molecular formula C15H22N2O4S and molecular weight 326.13 g/mol. IUPAC: ethyl 5-(2-amino-1,3-thiazol-4-yl)-3-butyl-5-methyl-2-oxooxolane-3-carboxylate.
Chemical Property Profile of TimTec1_006781
Property Insights of TimTec1_006781
The XLogP value of 2.6271 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_006781. The TPSA of 91.51 Ų falls within the moderate polarity range, balancing permeability and solubility for TimTec1_006781. Following Lipinski's Rule of Five, TimTec1_006781 has 1 hydrogen bond donor(s) and 7 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 TimTec1_006781?
The CAS number of TimTec1_006781 is 371946-43-9.
What is the molecular formula of TimTec1_006781?
The molecular formula of TimTec1_006781 is C15H22N2O4S.
What is the molecular weight of TimTec1_006781?
The molecular weight of TimTec1_006781 is 326.13 g/mol.
Where can I buy TimTec1_006781?
You can request a quote for TimTec1_006781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TimTec1_006781?
Yes, KEHONG BIO provides custom synthesis services for TimTec1_006781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.