2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-
TL;DR: 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- (CAS 132634-48-1) is a chemical compound with molecular formula C21H23ClFN3O3 and molecular weight 419.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-6-[(1R,2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxypropyl]-3-methyl-1,3-benzoxazol-2-one
Also Known As: 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-, 5-chloro-6-[(1R,2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxypropyl]-3-methyl-1,3-benzoxazol-2-one, 5-Chloro-6-{(1R,2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxypropyl}-3-methyl-1,3-benzoxazol-2(3H)-one, RefChem:241535
| Molecular Formula | C21H23ClFN3O3 |
|---|---|
| Molecular Weight | 419.14 g/mol |
| LogP | 3.1681 |
| Topological Polar Surface Area | 61.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.1412 |
| Heavy Atoms | 29 |
| Complexity | 1071.2051 |
Chemical Identifiers
| CAS Number | 132634-48-1 |
|---|---|
| SMILES | C[C@@H]([C@@H](C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=C(C=C4)F |
Product Overview
2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- (CAS 132634-48-1), with molecular formula C21H23ClFN3O3 and molecular weight 419.14 g/mol. IUPAC: 5-chloro-6-[(1R,2S)-2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxypropyl]-3-methyl-1,3-benzoxazol-2-one.
Chemical Property Profile of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-
Property Insights of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-
The XLogP value of 3.1681 indicates that 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-. Following Lipinski's Rule of Five, 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- has 1 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 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-?
The CAS number of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- is 132634-48-1.
What is the molecular formula of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-?
The molecular formula of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- is C21H23ClFN3O3.
What is the molecular weight of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-?
The molecular weight of 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- is 419.14 g/mol.
Where can I buy 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-?
You can request a quote for 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)-?
Yes, KEHONG BIO provides custom synthesis services for 2(3H)-Benzoxazolone, 5-chloro-6-(2-(4-(4-fluorophenyl)-1-piperazinyl)-1-hydroxypropyl)-3-methyl-, (R*,S*)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.