RefChem:237159
TL;DR: RefChem:237159 (CAS 67196-48-9) is a chemical compound with molecular formula C21H30Cl2N4OS and molecular weight 456.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)-1,4-diazepan-1-yl]ethanol;dihydrochloride
Also Known As: 1H-1,4-Diazepine-1-ethanol, hexahydro-4-(3-(10H-pyrido(3,2-b)(1,4)benzothiazin-10-yl)propyl)-, dihydrochloride, 10-(3-(4-Oxyaethylhomopiperazino)propyl-(1))-4-azaphenthiazin dihydrochlorid [German], 10-(3-(4-Oxyaethylhomopiperazino)propyl-(1))-4-azaphenthiazin dihydrochlorid, 1H-1,4-Diazepine-1-ethanol, hexahydro-4-[3-(10H-pyrido[3,2-b][1,4]benzothiazin-10-yl)propyl]-, dihydrochloride, 2-[4-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)-1,4-diazepan-1-yl]ethanol dihydrochloride
| Molecular Formula | C21H30Cl2N4OS |
|---|---|
| Molecular Weight | 456.15 g/mol |
| LogP | 3.918 |
| Topological Polar Surface Area | 42.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 456.15173 |
| Heavy Atoms | 29 |
| Complexity | 721.4659 |
Chemical Identifiers
| CAS Number | 67196-48-9 |
|---|---|
| SMILES | C1CN(CCN(C1)CCO)CCCN2C3=CC=CC=C3SC4=C2N=CC=C4.Cl.Cl |
Product Overview
RefChem:237159 (CAS 67196-48-9), with molecular formula C21H30Cl2N4OS and molecular weight 456.15 g/mol. IUPAC: 2-[4-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)-1,4-diazepan-1-yl]ethanol;dihydrochloride.
Chemical Property Profile of RefChem:237159
Property Insights of RefChem:237159
The XLogP value of 3.918 indicates that RefChem:237159 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.84 Ų, RefChem:237159 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:237159 has 1 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 RefChem:237159?
The CAS number of RefChem:237159 is 67196-48-9.
What is the molecular formula of RefChem:237159?
The molecular formula of RefChem:237159 is C21H30Cl2N4OS.
What is the molecular weight of RefChem:237159?
The molecular weight of RefChem:237159 is 456.15 g/mol.
Where can I buy RefChem:237159?
You can request a quote for RefChem:237159 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:237159?
Yes, KEHONG BIO provides custom synthesis services for RefChem:237159 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.