![7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one structure](/static/products/5434/5434-36-6.webp)
7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one
TL;DR: 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one (CAS 5434-36-6) is a chemical compound with molecular formula C24H31ClN2OS and molecular weight 430.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-1-[2-(dibutylamino)ethylamino]-4-methylthioxanthen-9-one
Also Known As: 7-chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one, 7-chloro-1-[2-(dibutylamino)ethylamino]-4-methylthioxanthen-9-one, 7-Chloro-1-{[2-(dibutylamino)ethyl]amino}-4-methyl-9H-thioxanthen-9-one
| Molecular Formula | C24H31ClN2OS |
|---|---|
| Molecular Weight | 430.18 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 430.18457 |
| Heavy Atoms | 29 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 5434-36-6 |
|---|---|
| SMILES | CCCCN(CCCC)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=C(C=C3)Cl |
| InChIKey | PJXBWHHJRBUQSI-UHFFFAOYSA-N |
Product Overview
7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one (CAS 5434-36-6), with molecular formula C24H31ClN2OS and molecular weight 430.18 g/mol. IUPAC: 7-chloro-1-[2-(dibutylamino)ethylamino]-4-methylthioxanthen-9-one.
Chemical Property Profile of 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one
Property Insights of 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one
The XLogP value of 6.3 indicates that 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one 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 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one?
The CAS number of 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one is 5434-36-6.
What is the molecular formula of 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one?
The molecular formula of 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one is C24H31ClN2OS.
What is the molecular weight of 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one?
The molecular weight of 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one is 430.18 g/mol.
Where can I buy 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one?
You can request a quote for 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Chloro-1-[2-(dibutylamino)ethylamino]-4-methyl-thioxanthen-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.