RefChem:350397
TL;DR: RefChem:350397 (CAS 28747-82-2) is a chemical compound with molecular formula C21H26Cl3N3O2S and molecular weight 489.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chlorophenothiazin-10-yl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one;dihydrochloride
Also Known As: Ketone, 2-chlorophenothiazin-10-yl 2-(4-(2-hydroxyethyl)-1-piperazinyl)ethyl, dihydrochloride, Phenothiazine, 2-chloro-10-(3-(4-(2-hydroxyethyl)-1-piperazinyl)propionyl)-, dihydrochloride, 1-(2-chlorophenothiazin-10-yl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one dihydrochloride, 1-(2-Chloro-10H-phenothiazin-10-yl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one--hydrogen chloride (1/2), Phenothiazine, 2-chloro-10-[3-[4-(2-hydroxyethyl)-1-piperazinyl]propionyl]-, dihydrochloride
| Molecular Formula | C21H26Cl3N3O2S |
|---|---|
| Molecular Weight | 489.08 g/mol |
| LogP | 4.31 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 489.08115 |
| Heavy Atoms | 30 |
| Complexity | 532.0 |
Chemical Identifiers
| CAS Number | 28747-82-2 |
|---|---|
| SMILES | C1CN(CCN1CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)Cl)CCO.Cl.Cl |
| InChIKey | PRYMXHIMDPCGRF-UHFFFAOYSA-N |
Product Overview
RefChem:350397 (CAS 28747-82-2), with molecular formula C21H26Cl3N3O2S and molecular weight 489.08 g/mol. IUPAC: 1-(2-chlorophenothiazin-10-yl)-3-[4-(2-hydroxyethyl)piperazin-1-yl]propan-1-one;dihydrochloride.
Chemical Property Profile of RefChem:350397
Property Insights of RefChem:350397
The XLogP value of 4.31 indicates that RefChem:350397 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:350397. Following Lipinski's Rule of Five, RefChem:350397 has 3 hydrogen bond donor(s) and 5 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:350397?
The CAS number of RefChem:350397 is 28747-82-2.
What is the molecular formula of RefChem:350397?
The molecular formula of RefChem:350397 is C21H26Cl3N3O2S.
What is the molecular weight of RefChem:350397?
The molecular weight of RefChem:350397 is 489.08 g/mol.
Where can I buy RefChem:350397?
You can request a quote for RefChem:350397 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:350397?
Yes, KEHONG BIO provides custom synthesis services for RefChem:350397 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.