N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate
TL;DR: N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate (CAS 58-35-5) is a chemical compound with molecular formula C22H32N2O4S2 and molecular weight 452.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl-methyl-(1-phenothiazin-10-ylpropan-2-yl)azanium;ethyl sulfate
Also Known As: Diethylmethyl(1-methyl-2-phenothiazin-10-ylethyl)ammonium ethyl sulfate, 10H-Phenothiazine-10-ethanaminium, N,N-diethyl-N,alpha-dimethyl-, ethyl sulfate, N-(2-Diaethylmethylammonium-2-methylaethyl)phenothiazin-aethosulfat [German], Ammonium, diethylmethyl(2-phenothiazin-10-ylpropyl)-, ethyl sulfate, N-(2-Diaethylmethylammonium-2-methylaethyl)phenothiazin-aethosulfat
| Molecular Formula | C22H32N2O4S2 |
|---|---|
| Molecular Weight | 452.18 g/mol |
| LogP | 4.65 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.18036 |
| Heavy Atoms | 30 |
| Complexity | 464.0 |
Chemical Identifiers
| CAS Number | 58-35-5 |
|---|---|
| SMILES | CC[N+](C)(CC)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31.CCOS(=O)(=O)[O-] |
| InChIKey | IDCUMDAEMYMVJH-UHFFFAOYSA-M |
Product Overview
N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate (CAS 58-35-5), with molecular formula C22H32N2O4S2 and molecular weight 452.18 g/mol. IUPAC: diethyl-methyl-(1-phenothiazin-10-ylpropan-2-yl)azanium;ethyl sulfate.
Chemical Property Profile of N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate
Property Insights of N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate
The XLogP value of 4.65 indicates that N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate. Following Lipinski's Rule of Five, N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate has 0 hydrogen bond donor(s) and 6 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 N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate?
The CAS number of N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate is 58-35-5.
What is the molecular formula of N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate?
The molecular formula of N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate is C22H32N2O4S2.
What is the molecular weight of N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate?
The molecular weight of N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate is 452.18 g/mol.
Where can I buy N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate?
You can request a quote for N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diethyl-N-methyl-1-(10H-phenothiazin-10-yl)propan-2-aminium ethyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.