8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride
TL;DR: 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride (CAS 2903-43-7) is a chemical compound with molecular formula C18H25ClN2O3S and molecular weight 384.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro[4.5]decan-3-one;hydrochloride
Also Known As: 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride, 1-Thia-4,8-diazaspiro(4.5)decan-3-one, 8-(1,4-benzodioxan-2-ylmethyl)-4-ethyl-, monohydrochloride, 8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-ethyl-1-thia-4,, 8-(2,3-dihydro-1,4-benzodioxin-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro[4.5]decan-3-one hydrochloride(1:1), 1-Thia-4,8-diazaspiro(4.5)decan-3-one,8-(1,4-benzodioxan-2-ylmethyl)-4-ethyl-,monohydrochloride
| Molecular Formula | C18H25ClN2O3S |
|---|---|
| Molecular Weight | 384.13 g/mol |
| LogP | 2.6356 |
| Topological Polar Surface Area | 67.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 384.12744 |
| Heavy Atoms | 25 |
| Complexity | 467.0 |
Chemical Identifiers
| CAS Number | 2903-43-7 |
|---|---|
| SMILES | CCN1C(=O)CSC12CCN(CC2)CC3COC4=CC=CC=C4O3.Cl |
| InChIKey | SJKVVERGLVWKIZ-UHFFFAOYSA-N |
Product Overview
8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride (CAS 2903-43-7), with molecular formula C18H25ClN2O3S and molecular weight 384.13 g/mol. IUPAC: 8-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro[4.5]decan-3-one;hydrochloride.
Chemical Property Profile of 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride
Property Insights of 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride
The XLogP value of 2.6356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride. The TPSA of 67.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride. Following Lipinski's Rule of Five, 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride 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 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride?
The CAS number of 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride is 2903-43-7.
What is the molecular formula of 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride?
The molecular formula of 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride is C18H25ClN2O3S.
What is the molecular weight of 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride?
The molecular weight of 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride is 384.13 g/mol.
Where can I buy 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride?
You can request a quote for 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 8-(1,4-Benzodioxan-2-ylmethyl)-4-ethyl-1-thia-4,8-diazaspiro(4.5)decan-3-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.