2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone
TL;DR: 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone (CAS 39280-04-1) is a chemical compound with molecular formula C23H28N2OS and molecular weight 380.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(diethylamino)ethylamino]-1,2,3,4-tetrahydrobenzo[c]thioxanthen-7-one
Also Known As: Deaea-chtx, 2-(beta-Diethylaminoethylamino)-3,4-cyclohexenothiaxanthone, 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone, 7H-Benzo(c)thioxanthen-7-one, 5-((2-(diethylamino)ethyl)amino)-1,2,3,4-tetrahydro-, 5-(2-diethylaminoethylamino)-1,2,3,4-tetrahydrobenzo[c]thioxanthen-7-one
| Molecular Formula | C23H28N2OS |
|---|---|
| Molecular Weight | 380.19 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 380.19223 |
| Heavy Atoms | 27 |
| Complexity | 509.0 |
Chemical Identifiers
| CAS Number | 39280-04-1 |
|---|---|
| SMILES | CCN(CC)CCNC1=C2CCCCC2=C3C(=C1)C(=O)C4=CC=CC=C4S3 |
| InChIKey | AINFFKFGHUKSDZ-UHFFFAOYSA-N |
Product Overview
2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone (CAS 39280-04-1), with molecular formula C23H28N2OS and molecular weight 380.19 g/mol. IUPAC: 5-[2-(diethylamino)ethylamino]-1,2,3,4-tetrahydrobenzo[c]thioxanthen-7-one.
Chemical Property Profile of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone
Property Insights of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone
The XLogP value of 5.6 indicates that 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone?
The CAS number of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone is 39280-04-1.
What is the molecular formula of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone?
The molecular formula of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone is C23H28N2OS.
What is the molecular weight of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone?
The molecular weight of 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone is 380.19 g/mol.
Where can I buy 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone?
You can request a quote for 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone?
Yes, KEHONG BIO provides custom synthesis services for 2-(Beta-diethylaminoethylamino)-3,4-cyclohexenothia-xanthone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.