Irolapride
TL;DR: Irolapride (CAS 64779-98-2) is a chemical compound with molecular formula C19H28N2O3 and molecular weight 332.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butanoyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxybenzamide
Also Known As: Irolapride, irolaprida, Irolapride [INN], irolapridum, 5-butanoyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxybenzamide
| Molecular Formula | C19H28N2O3 |
|---|---|
| Molecular Weight | 332.21 g/mol |
| LogP | 2.8921 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 332.21 |
| Heavy Atoms | 24 |
| Complexity | 585.9747 |
Chemical Identifiers
| CAS Number | 64779-98-2 |
|---|---|
| SMILES | CCCC(=O)C1=CC(=C(C=C1)OC)C(=O)NCC2CCCN2CC |
Product Overview
Irolapride (CAS 64779-98-2), with molecular formula C19H28N2O3 and molecular weight 332.21 g/mol. IUPAC: 5-butanoyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-2-methoxybenzamide.
Chemical Property Profile of Irolapride
Property Insights of Irolapride
The XLogP value of 2.8921 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Irolapride. With a topological polar surface area (TPSA) of 58.64 Ų, Irolapride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Irolapride has 1 hydrogen bond donor(s) and 4 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 Irolapride?
The CAS number of Irolapride is 64779-98-2.
What is the molecular formula of Irolapride?
The molecular formula of Irolapride is C19H28N2O3.
What is the molecular weight of Irolapride?
The molecular weight of Irolapride is 332.21 g/mol.
Where can I buy Irolapride?
You can request a quote for Irolapride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Irolapride?
Yes, KEHONG BIO provides custom synthesis services for Irolapride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.