RefChem:334504
TL;DR: RefChem:334504 (CAS 55247-73-9) is a chemical compound with molecular formula C25H29NO6 and molecular weight 439.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethenylpyrrolidin-2-one;2-(7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl)propyl 3-methylbut-2-enoate
Also Known As: Crotonic acid, 3-methyl-, ester with 2,3-dihydro-2-(1-hydroxy-1-methylethyl)-7H-furo(3,2-g)(1)benzopyran-7-one, (-)-, mixed with N-vinylpyrrolidone (14:86), 1-ethenylpyrrolidin-2-one;2-(7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl)propyl 3-methylbut-2-enoate, CROTONIC ACID, 3-METHYL-, ESTER with 2,3-DIHYDRO-2-(1-HYDROXY-1-METHYLETHYL)-7H-, 1-ethenylpyrrolidin-2-one; 2-(7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl)propyl 3-methylbut-2-enoate, 2-(7-Oxo-2,3-dihydro-7H-furo[3,2-g][1]benzopyran-2-yl)propyl 3-methylbut-2-enoate--1-ethenylpyrrolidin-2-one (1/1)
| Molecular Formula | C25H29NO6 |
|---|---|
| Molecular Weight | 439.20 g/mol |
| LogP | 3.99 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.1995 |
| Heavy Atoms | 32 |
| Complexity | 680.0 |
Chemical Identifiers
| CAS Number | 55247-73-9 |
|---|---|
| SMILES | CC(COC(=O)C=C(C)C)C1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3.C=CN1CCCC1=O |
| InChIKey | FYGLTXDKUMDSCU-UHFFFAOYSA-N |
Product Overview
RefChem:334504 (CAS 55247-73-9), with molecular formula C25H29NO6 and molecular weight 439.20 g/mol. IUPAC: 1-ethenylpyrrolidin-2-one;2-(7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl)propyl 3-methylbut-2-enoate.
Chemical Property Profile of RefChem:334504
Property Insights of RefChem:334504
The XLogP value of 3.99 indicates that RefChem:334504 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:334504. Following Lipinski's Rule of Five, RefChem:334504 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 RefChem:334504?
The CAS number of RefChem:334504 is 55247-73-9.
What is the molecular formula of RefChem:334504?
The molecular formula of RefChem:334504 is C25H29NO6.
What is the molecular weight of RefChem:334504?
The molecular weight of RefChem:334504 is 439.20 g/mol.
Where can I buy RefChem:334504?
You can request a quote for RefChem:334504 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:334504?
Yes, KEHONG BIO provides custom synthesis services for RefChem:334504 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.