Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate
TL;DR: Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate (CAS 36677-73-3) is a chemical compound with molecular formula C18H20ClNO2S and molecular weight 349.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(dimethylamino)propoxy]thioxanthen-9-one;hydrochloride
Also Known As: 2-(3-Dimethylaminopropoxy)thioxanthone hydrochloride monohydrate, Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate, 2-[3-(dimethylamino)propoxy]-9h-thioxanthen-9-one hydrochloride(1:1), 2-[3-(dimethylamino)propoxy]thioxanthen-9-one hydrochloride, 2-[3-(dimethylamino)propoxy]thioxanthen-9-one,hydrochloride
| Molecular Formula | C18H20ClNO2S |
|---|---|
| Molecular Weight | 349.09 g/mol |
| LogP | 4.167 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 349.09033 |
| Heavy Atoms | 23 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 36677-73-3 |
|---|---|
| SMILES | CN(C)CCCOC1=CC2=C(C=C1)SC3=CC=CC=C3C2=O.Cl |
| InChIKey | OGVKQKLMONCNCB-UHFFFAOYSA-N |
Product Overview
Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate (CAS 36677-73-3), with molecular formula C18H20ClNO2S and molecular weight 349.09 g/mol. IUPAC: 2-[3-(dimethylamino)propoxy]thioxanthen-9-one;hydrochloride.
Chemical Property Profile of Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate
Property Insights of Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate
The XLogP value of 4.167 indicates that Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.8 Ų, Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate 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 Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate?
The CAS number of Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate is 36677-73-3.
What is the molecular formula of Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate?
The molecular formula of Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate is C18H20ClNO2S.
What is the molecular weight of Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate?
The molecular weight of Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate is 349.09 g/mol.
Where can I buy Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate?
You can request a quote for Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate?
Yes, KEHONG BIO provides custom synthesis services for Thioxanthen-9-one, 2-(3-(dimethylamino)propoxy)-, hydrochloride, hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.