(25R)-3
TL;DR: (25R)-3 (CAS 5874-17-9) is a chemical compound with molecular formula C24H21N3O2 and molecular weight 383.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[1-(4-acetylphenyl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-phenylprop-2-enamide
Also Known As: (25R)-3, A-acetoxy-5-hydroxy-5, A-spirostan-6-one, (25R)-spirost-3, A,5
| Molecular Formula | C24H21N3O2 |
|---|---|
| Molecular Weight | 383.16 g/mol |
| LogP | 4.84242 |
| Topological Polar Surface Area | 74.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 383.1634 |
| Heavy Atoms | 29 |
| Complexity | 1131.364 |
Chemical Identifiers
| CAS Number | 5874-17-9 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CC=C(C=C2)C(=O)C)C)/C=C(\C#N)/C(=O)NC3=CC=CC=C3 |
Product Overview
(25R)-3 (CAS 5874-17-9), with molecular formula C24H21N3O2 and molecular weight 383.16 g/mol. IUPAC: (E)-3-[1-(4-acetylphenyl)-2,5-dimethylpyrrol-3-yl]-2-cyano-N-phenylprop-2-enamide.
Chemical Property Profile of (25R)-3
Property Insights of (25R)-3
The XLogP value of 4.84242 indicates that (25R)-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.89 Ų falls within the moderate polarity range, balancing permeability and solubility for (25R)-3. Following Lipinski's Rule of Five, (25R)-3 has 1 hydrogen bond donor(s) and 3 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 (25R)-3?
The CAS number of (25R)-3 is 5874-17-9.
What is the molecular formula of (25R)-3?
The molecular formula of (25R)-3 is C24H21N3O2.
What is the molecular weight of (25R)-3?
The molecular weight of (25R)-3 is 383.16 g/mol.
Where can I buy (25R)-3?
You can request a quote for (25R)-3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (25R)-3?
Yes, KEHONG BIO provides custom synthesis services for (25R)-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.