3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
TL;DR: 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine (CAS 16260-06-3) is a chemical compound with molecular formula C18H18ClNOS and molecular weight 331.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
Also Known As: Chlorprothixene Sulfoxide Oxalate
| Molecular Formula | C18H18ClNOS |
|---|---|
| Molecular Weight | 331.08 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 39.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.07977 |
| Heavy Atoms | 22 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 16260-06-3 |
|---|---|
| SMILES | CN(C)CCC=C1C2=CC=CC=C2S(=O)C3=C1C=C(C=C3)Cl |
| InChIKey | FIRHWYHHSBEFJB-UHFFFAOYSA-N |
Product Overview
3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine (CAS 16260-06-3), with molecular formula C18H18ClNOS and molecular weight 331.08 g/mol. IUPAC: 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine.
Chemical Property Profile of 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
Property Insights of 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine
The XLogP value of 3.9 indicates that 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.5 Ų, 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine has 0 hydrogen bond donor(s) and 3 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 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine?
The CAS number of 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine is 16260-06-3.
What is the molecular formula of 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine?
The molecular formula of 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine is C18H18ClNOS.
What is the molecular weight of 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine?
The molecular weight of 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine is 331.08 g/mol.
Where can I buy 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine?
You can request a quote for 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-chloro-10-oxothioxanthen-9-ylidene)-N,N-dimethylpropan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.