2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone
TL;DR: 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone (CAS 641-33-8) is a chemical compound with molecular formula C18H20N2OS and molecular weight 312.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)-1-phenothiazin-10-ylethanone
Also Known As: Diphasin, Diphasine, Diphazine, Difazin, Apocodeine
| Molecular Formula | C18H20N2OS |
|---|---|
| Molecular Weight | 312.13 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 48.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.12964 |
| Heavy Atoms | 22 |
| Complexity | 363.0 |
| Solubility | >46.9 [ug/mL] (The mean of the results at pH 7.4) |
Chemical Identifiers
| CAS Number | 641-33-8 |
|---|---|
| SMILES | CCN(CC)CC(=O)N1C2=CC=CC=C2SC3=CC=CC=C31 |
| InChIKey | BPWOKDWTZDTHNX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone (CAS 641-33-8), with molecular formula C18H20N2OS and molecular weight 312.13 g/mol. IUPAC: 2-(diethylamino)-1-phenothiazin-10-ylethanone.
Chemical Property Profile of 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone
Property Insights of 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone
The XLogP value of 3.8 indicates that 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.9 Ų, 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone 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 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone?
The CAS number of 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone is 641-33-8.
What is the molecular formula of 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone?
The molecular formula of 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone is C18H20N2OS.
What is the molecular weight of 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone?
The molecular weight of 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone is 312.13 g/mol.
Where can I buy 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone?
You can request a quote for 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino)-1-(10H-phenothiazin-10-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.