VU0509421-1
TL;DR: VU0509421-1 (CAS 1005151-29-0) is a chemical compound with molecular formula C21H23N3O4 and molecular weight 381.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-5-ethyl-3-(4-hydroxy-3-methoxyphenyl)-2,3,3a,6a-tetrahydropyrrolo[3,4-c]pyrazole-4,6-dione
Also Known As: VU0509421-1, VU0509421-2, F3115-0072, 1-benzyl-5-ethyl-3-(4-hydroxy-3-methoxyphenyl)tetrahydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione, 1-benzyl-5-ethyl-3-(4-hydroxy-3-methoxyphenyl)-octahydropyrrolo[3,4-c]pyrazole-4,6-dione
| Molecular Formula | C21H23N3O4 |
|---|---|
| Molecular Weight | 381.17 g/mol |
| LogP | 1.8358 |
| Topological Polar Surface Area | 82.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 381.16885 |
| Heavy Atoms | 28 |
| Complexity | 901.7786 |
Chemical Identifiers
| CAS Number | 1005151-29-0 |
|---|---|
| SMILES | CCN1C(=O)C2C(NN(C2C1=O)CC3=CC=CC=C3)C4=CC(=C(C=C4)O)OC |
Product Overview
VU0509421-1 (CAS 1005151-29-0), with molecular formula C21H23N3O4 and molecular weight 381.17 g/mol. IUPAC: 1-benzyl-5-ethyl-3-(4-hydroxy-3-methoxyphenyl)-2,3,3a,6a-tetrahydropyrrolo[3,4-c]pyrazole-4,6-dione.
Chemical Property Profile of VU0509421-1
Property Insights of VU0509421-1
The XLogP value of 1.8358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0509421-1. The TPSA of 82.11 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0509421-1. Following Lipinski's Rule of Five, VU0509421-1 has 2 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 VU0509421-1?
The CAS number of VU0509421-1 is 1005151-29-0.
What is the molecular formula of VU0509421-1?
The molecular formula of VU0509421-1 is C21H23N3O4.
What is the molecular weight of VU0509421-1?
The molecular weight of VU0509421-1 is 381.17 g/mol.
Where can I buy VU0509421-1?
You can request a quote for VU0509421-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0509421-1?
Yes, KEHONG BIO provides custom synthesis services for VU0509421-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.