Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride
TL;DR: Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride (CAS 1936-49-8) is a chemical compound with molecular formula C17H19ClN2O2S and molecular weight 350.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-[2-(dimethylamino)ethyl] phenoxazine-10-carbothioate;hydrochloride
Also Known As: Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride, S-(2-(Dimethylamino)ethyl) ester of phenoxazine-10-carbothioic acid hydrochloride, S-(2-dimethylaminoethyl) phenoxazine-10-carbothioate hydrochloride, s-[2-(dimethylamino)ethyl] 10h-phenoxazine-10-carbothioate hydrochloride(1:1), S-[2-(Dimethylamino)ethyl] 10H-phenoxazine-10-carbothioate--hydrogen chloride (1/1)
| Molecular Formula | C17H19ClN2O2S |
|---|---|
| Molecular Weight | 350.09 g/mol |
| LogP | 4.77 |
| Topological Polar Surface Area | 58.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.08557 |
| Heavy Atoms | 23 |
| Complexity | 369.0 |
Chemical Identifiers
| CAS Number | 1936-49-8 |
|---|---|
| SMILES | CN(C)CCSC(=O)N1C2=CC=CC=C2OC3=CC=CC=C31.Cl |
| InChIKey | RZUWOPGWOQCCJU-UHFFFAOYSA-N |
Product Overview
Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride (CAS 1936-49-8), with molecular formula C17H19ClN2O2S and molecular weight 350.09 g/mol. IUPAC: S-[2-(dimethylamino)ethyl] phenoxazine-10-carbothioate;hydrochloride.
Chemical Property Profile of Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride
Property Insights of Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride
The XLogP value of 4.77 indicates that Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.1 Ų, Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride 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 Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride?
The CAS number of Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride is 1936-49-8.
What is the molecular formula of Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride?
The molecular formula of Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride is C17H19ClN2O2S.
What is the molecular weight of Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride?
The molecular weight of Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride is 350.09 g/mol.
Where can I buy Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride?
You can request a quote for Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Phenoxazine-10-carbothioic acid, S-(2-(dimethylamino)ethyl) ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.