1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol
TL;DR: 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol (CAS 132634-41-4) is a chemical compound with molecular formula C21H24ClN3O4 and molecular weight 417.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-[1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3-methyl-1,3-benzoxazol-2-one
Also Known As: 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol, 2(3H)-Benzoxazolone, 5-chloro-6-(1-hydroxy-2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-3-methyl-, 5-Chloro-3-methyl-6-[2-[4-[2-methoxyphenyl]piperazin-1-yl]-1-hydroxyethyl]benzoxazol-2(3H)-one, 5-chloro-6-[1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3-methyl-1,3-benzoxazol-2-one, 5-Chloro-6-{1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}-3-methyl-1,3-benzoxazol-2(3H)-one
| Molecular Formula | C21H24ClN3O4 |
|---|---|
| Molecular Weight | 417.15 g/mol |
| LogP | 2.6491 |
| Topological Polar Surface Area | 71.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 417.14554 |
| Heavy Atoms | 29 |
| Complexity | 1069.4637 |
Chemical Identifiers
| CAS Number | 132634-41-4 |
|---|---|
| SMILES | CN1C2=C(C=C(C(=C2)Cl)C(CN3CCN(CC3)C4=CC=CC=C4OC)O)OC1=O |
Product Overview
1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol (CAS 132634-41-4), with molecular formula C21H24ClN3O4 and molecular weight 417.15 g/mol. IUPAC: 5-chloro-6-[1-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-3-methyl-1,3-benzoxazol-2-one.
Chemical Property Profile of 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol
Property Insights of 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol
The XLogP value of 2.6491 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol. The TPSA of 71.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol. Following Lipinski's Rule of Five, 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol 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 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol?
The CAS number of 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol is 132634-41-4.
What is the molecular formula of 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol?
The molecular formula of 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol is C21H24ClN3O4.
What is the molecular weight of 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol?
The molecular weight of 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol is 417.15 g/mol.
Where can I buy 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol?
You can request a quote for 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methyl-5-chloro-2-benzoxazolinone-6-yl)-2-(4-(2-methoxyphenyl)piperazine-1-yl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.