8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet
TL;DR: 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet (CAS 4461-80-7) is a chemical compound with molecular formula C20H28N2O2S and molecular weight 360.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tetrahydrothioxanthen-9-one
Also Known As: 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet, 8-(2-diethylaminoethylamino)-5-(hydroxymethyl)-1,2,3,4-tetrahydrothioxanthen-9-one, 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tetrahydrothioxanthen-9-one, 8-{[2-(Diethylamino)ethyl]amino}-5-(hydroxymethyl)-1,2,3,4-tetrahydro-9H-thioxanthen-9-one
| Molecular Formula | C20H28N2O2S |
|---|---|
| Molecular Weight | 360.19 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 77.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 360.18716 |
| Heavy Atoms | 25 |
| Complexity | 504.0 |
Chemical Identifiers
| CAS Number | 4461-80-7 |
|---|---|
| SMILES | CCN(CC)CCNC1=C2C(=C(C=C1)CO)SC3=C(C2=O)CCCC3 |
| InChIKey | PGWRDXUUOVDJJF-UHFFFAOYSA-N |
Product Overview
8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet (CAS 4461-80-7), with molecular formula C20H28N2O2S and molecular weight 360.19 g/mol. IUPAC: 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tetrahydrothioxanthen-9-one.
Chemical Property Profile of 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet
Property Insights of 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet
The XLogP value of 3.7 indicates that 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet. Following Lipinski's Rule of Five, 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet has 2 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-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet?
The CAS number of 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet is 4461-80-7.
What is the molecular formula of 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet?
The molecular formula of 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet is C20H28N2O2S.
What is the molecular weight of 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet?
The molecular weight of 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet is 360.19 g/mol.
Where can I buy 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet?
You can request a quote for 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet?
Yes, KEHONG BIO provides custom synthesis services for 8-[2-(diethylamino)ethylamino]-5-(hydroxymethyl)-1,2,3,4-tet and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.