Proglumetacin
TL;DR: Proglumetacin (CAS 57132-53-3) is a chemical compound with molecular formula C46H58ClN5O8 and molecular weight 843.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyethyl]piperazin-1-yl]propyl 4-benzamido-5-(dipropylamino)-5-oxopentanoate
Also Known As: PROGLUMETACIN, Proglumetacina, Proglumetacine, Proglumetacinum, Protacine
| Molecular Formula | C46H58ClN5O8 |
|---|---|
| Molecular Weight | 843.40 g/mol |
| LogP | 7.3 |
| Topological Polar Surface Area | 140.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 23 |
| Exact Mass | 843.3974 |
| Heavy Atoms | 60 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 57132-53-3 |
|---|---|
| SMILES | CCCN(CCC)C(=O)C(CCC(=O)OCCCN1CCN(CC1)CCOC(=O)CC2=C(N(C3=C2C=C(C=C3)OC)C(=O)C4=CC=C(C=C4)Cl)C)NC(=O)C5=CC=CC=C5 |
| InChIKey | PTXGHCGBYMQQIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Proglumetacin (CAS 57132-53-3), with molecular formula C46H58ClN5O8 and molecular weight 843.40 g/mol. IUPAC: 3-[4-[2-[2-[1-(4-chlorobenzoyl)-5-methoxy-2-methylindol-3-yl]acetyl]oxyethyl]piperazin-1-yl]propyl 4-benzamido-5-(dipropylamino)-5-oxopentanoate.
Chemical Property Profile of Proglumetacin
Property Insights of Proglumetacin
The XLogP value of 7.3 indicates that Proglumetacin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 140.0 Ų indicates high polarity, suggesting Proglumetacin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Proglumetacin has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Proglumetacin?
The CAS number of Proglumetacin is 57132-53-3.
What is the molecular formula of Proglumetacin?
The molecular formula of Proglumetacin is C46H58ClN5O8.
What is the molecular weight of Proglumetacin?
The molecular weight of Proglumetacin is 843.40 g/mol.
Where can I buy Proglumetacin?
You can request a quote for Proglumetacin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Proglumetacin?
Yes, KEHONG BIO provides custom synthesis services for Proglumetacin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.