N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide
TL;DR: N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide (CAS 6000-03-9) is a chemical compound with molecular formula C26H27BrN4O4 and molecular weight 538.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-2-oxoethyl]-2-methoxy-N-prop-2-enylbenzamide
Also Known As: N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide, N-[2-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-2-oxoethyl]-2-methoxy-N-prop-2-enylbenzamide
| Molecular Formula | C26H27BrN4O4 |
|---|---|
| Molecular Weight | 538.12 g/mol |
| LogP | 4.8897 |
| Topological Polar Surface Area | 88.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 538.1216 |
| Heavy Atoms | 35 |
| Complexity | 1194.0723 |
Chemical Identifiers
| CAS Number | 6000-03-9 |
|---|---|
| SMILES | COC1=CC=CC=C1C(=O)N(CC=C)CC(=O)N2CCCCC2C3=NC(=NO3)C4=CC=C(C=C4)Br |
Product Overview
N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide (CAS 6000-03-9), with molecular formula C26H27BrN4O4 and molecular weight 538.12 g/mol. IUPAC: N-[2-[2-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-2-oxoethyl]-2-methoxy-N-prop-2-enylbenzamide.
Chemical Property Profile of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide
Property Insights of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide
The XLogP value of 4.8897 indicates that N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.77 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide. Following Lipinski's Rule of Five, N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide?
The CAS number of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide is 6000-03-9.
What is the molecular formula of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide?
The molecular formula of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide is C26H27BrN4O4.
What is the molecular weight of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide?
The molecular weight of N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide is 538.12 g/mol.
Where can I buy N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide?
You can request a quote for N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2-{2-[3-(4-Bromophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-2-oxoethyl)-2-methoxy-N-(prop-2-en-1-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.