KST-1B3686
TL;DR: KST-1B3686 (CAS 37291-76-2) is a chemical compound with molecular formula C17H28ClNO3 and molecular weight 329.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylamino)propan-2-yl 2-(5-methyl-2-propan-2-ylphenoxy)acetate;hydrochloride
Also Known As: KST-1B3686, T 2436, aceticacid, -,2-1-methylethylester,hydrochloride, Aceticacid, -,2- -1-methylethylester,hydrochloride, Acetic acid, (thymyloxy)-, 2-(dimethylamino)-1-methylethyl ester, hydrochloride
| Molecular Formula | C17H28ClNO3 |
|---|---|
| Molecular Weight | 329.18 g/mol |
| LogP | 3.41232 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 329.17578 |
| Heavy Atoms | 22 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 37291-76-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OCC(=O)OC(C)CN(C)C.Cl |
| InChIKey | WBJFYHIISGMHJZ-UHFFFAOYSA-N |
Product Overview
KST-1B3686 (CAS 37291-76-2), with molecular formula C17H28ClNO3 and molecular weight 329.18 g/mol. IUPAC: 1-(dimethylamino)propan-2-yl 2-(5-methyl-2-propan-2-ylphenoxy)acetate;hydrochloride.
Chemical Property Profile of KST-1B3686
Property Insights of KST-1B3686
The XLogP value of 3.41232 indicates that KST-1B3686 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.8 Ų, KST-1B3686 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KST-1B3686 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 KST-1B3686?
The CAS number of KST-1B3686 is 37291-76-2.
What is the molecular formula of KST-1B3686?
The molecular formula of KST-1B3686 is C17H28ClNO3.
What is the molecular weight of KST-1B3686?
The molecular weight of KST-1B3686 is 329.18 g/mol.
Where can I buy KST-1B3686?
You can request a quote for KST-1B3686 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1B3686?
Yes, KEHONG BIO provides custom synthesis services for KST-1B3686 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.