RefChem:237158
TL;DR: RefChem:237158 (CAS 67196-47-8) is a chemical compound with molecular formula C23H32Cl2N4O2S and molecular weight 498.16 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]ethyl acetate;dihydrochloride
Also Known As: 1H-1,4-Diazepine-1-ethanol, hexahydro-4-(3-(10H-pyrido(3,2-b)(1,4)benzothiazin-10-yl)propyl)-, acetate, dihydrochloride, 10-(3-(4-(Acetoxyaethyl)homopiperazino)propyl-(1))-4-azaphenthiazin dihydrochlorid [German], 10-(3-(4-(Acetoxyaethyl)homopiperazino)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]-, acetate (ester), dihydrochloride, 2-[4-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)-1,4-diazepan-1-yl]ethyl acetate dihydrochloride
| Molecular Formula | C23H32Cl2N4O2S |
|---|---|
| Molecular Weight | 498.16 g/mol |
| LogP | 4.4888 |
| Topological Polar Surface Area | 48.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.1623 |
| Heavy Atoms | 32 |
| Complexity | 827.89496 |
Chemical Identifiers
| CAS Number | 67196-47-8 |
|---|---|
| SMILES | CC(=O)OCCN1CCCN(CC1)CCCN2C3=CC=CC=C3SC4=C2N=CC=C4.Cl.Cl |
Product Overview
RefChem:237158 (CAS 67196-47-8), with molecular formula C23H32Cl2N4O2S and molecular weight 498.16 g/mol. IUPAC: 2-[4-(3-pyrido[3,2-b][1,4]benzothiazin-10-ylpropyl)-1,4-diazepan-1-yl]ethyl acetate;dihydrochloride.
Chemical Property Profile of RefChem:237158
Property Insights of RefChem:237158
The XLogP value of 4.4888 indicates that RefChem:237158 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.91 Ų, RefChem:237158 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:237158 has 0 hydrogen bond donor(s) and 7 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:237158?
The CAS number of RefChem:237158 is 67196-47-8.
What is the molecular formula of RefChem:237158?
The molecular formula of RefChem:237158 is C23H32Cl2N4O2S.
What is the molecular weight of RefChem:237158?
The molecular weight of RefChem:237158 is 498.16 g/mol.
Where can I buy RefChem:237158?
You can request a quote for RefChem:237158 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:237158?
Yes, KEHONG BIO provides custom synthesis services for RefChem:237158 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.