indomethacin-NHS
TL;DR: indomethacin-NHS (CAS 104425-42-5) is a chemical compound with molecular formula C23H19ClN2O6 and molecular weight 454.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dioxopyrrolidin-1-yl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate
Also Known As: Indomethacin-nhs, Indomethacin N-hydroxysuccinimide, (2,5-dioxopyrrolidin-1-yl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate, N-Succinimidyl-1-(4-chlorobenzoyl)-5-methoxy-2-methyl-1H-indole-3-acetate, 1-(4-Chlorobenzoyl)-3-(2-((2,5-dioxo-1-pyrrolidinyl)oxy)-2-oxoethyl)-5-methoxy-2-methyl-1H-indole
| Molecular Formula | C23H19ClN2O6 |
|---|---|
| Molecular Weight | 454.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 94.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.09317 |
| Heavy Atoms | 32 |
| Complexity | 752.0 |
Chemical Identifiers
| CAS Number | 104425-42-5 |
|---|---|
| SMILES | CC1=C(C2=C(N1C(=O)C3=CC=C(C=C3)Cl)C=CC(=C2)OC)CC(=O)ON4C(=O)CCC4=O |
| InChIKey | UBRFPULIXPNAAL-UHFFFAOYSA-N |
Product Overview
indomethacin-NHS (CAS 104425-42-5), with molecular formula C23H19ClN2O6 and molecular weight 454.09 g/mol. IUPAC: (2,5-dioxopyrrolidin-1-yl) 2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetate.
Chemical Property Profile of indomethacin-NHS
Property Insights of indomethacin-NHS
The XLogP value of 3.7 indicates that indomethacin-NHS is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.9 Ų falls within the moderate polarity range, balancing permeability and solubility for indomethacin-NHS. Following Lipinski's Rule of Five, indomethacin-NHS has 0 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 indomethacin-NHS?
The CAS number of indomethacin-NHS is 104425-42-5.
What is the molecular formula of indomethacin-NHS?
The molecular formula of indomethacin-NHS is C23H19ClN2O6.
What is the molecular weight of indomethacin-NHS?
The molecular weight of indomethacin-NHS is 454.09 g/mol.
Where can I buy indomethacin-NHS?
You can request a quote for indomethacin-NHS directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for indomethacin-NHS?
Yes, KEHONG BIO provides custom synthesis services for indomethacin-NHS and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.