RefChem:311768
TL;DR: RefChem:311768 (CAS 153804-33-2) is a chemical compound with molecular formula C21H27NO4S and molecular weight 389.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[3-(3,4-dihydro-2H-thiochromen-8-yloxy)-2-hydroxypropyl]-8-azaspiro[4.5]decane-7,9-dione
Also Known As: 8-((3-(7,9-Dioxo-8-azaspiro(4.5)decan-8-yl)-2-hydroxypropyl)oxy)thiochroman, 8-Azaspiro(4.5)decane-7,9-dione, 8-(3-((3,4-dihydro-2H-1-benzothiopyran-8-yl)oxy)-2-hydroxypropyl)-, 8-[3-(3,4-dihydro-2H-thiochromen-8-yloxy)-2-hydroxypropyl]-8-azaspiro[4.5]decane-7,9-dione, 8-{3-[(3,4-Dihydro-2H-1-benzothiopyran-8-yl)oxy]-2-hydroxypropyl}-8-azaspiro[4.5]decane-7,9-dione, RefChem:311768
| Molecular Formula | C21H27NO4S |
|---|---|
| Molecular Weight | 389.17 g/mol |
| LogP | 3.174 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.16608 |
| Heavy Atoms | 27 |
| Complexity | 708.89185 |
Chemical Identifiers
| CAS Number | 153804-33-2 |
|---|---|
| SMILES | C1CCC2(C1)CC(=O)N(C(=O)C2)CC(COC3=CC=CC4=C3SCCC4)O |
Product Overview
RefChem:311768 (CAS 153804-33-2), with molecular formula C21H27NO4S and molecular weight 389.17 g/mol. IUPAC: 8-[3-(3,4-dihydro-2H-thiochromen-8-yloxy)-2-hydroxypropyl]-8-azaspiro[4.5]decane-7,9-dione.
Chemical Property Profile of RefChem:311768
Property Insights of RefChem:311768
The XLogP value of 3.174 indicates that RefChem:311768 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 RefChem:311768. Following Lipinski's Rule of Five, RefChem:311768 has 1 hydrogen bond donor(s) and 5 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 RefChem:311768?
The CAS number of RefChem:311768 is 153804-33-2.
What is the molecular formula of RefChem:311768?
The molecular formula of RefChem:311768 is C21H27NO4S.
What is the molecular weight of RefChem:311768?
The molecular weight of RefChem:311768 is 389.17 g/mol.
Where can I buy RefChem:311768?
You can request a quote for RefChem:311768 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:311768?
Yes, KEHONG BIO provides custom synthesis services for RefChem:311768 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.