VU0061059-1
TL;DR: VU0061059-1 (CAS 347353-62-2) is a chemical compound with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-benzodioxol-5-ylmethyl 4-(4-ethylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: VU0061059-1, 1,3-benzodioxol-5-ylmethyl 4-(4-ethylphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, (2H-1,3-BENZODIOXOL-5-YL)METHYL 4-(4-ETHYLPHENYL)-6-METHYL-2-OXO-1,2,3,4-TETRAHYDROPYRIMIDINE-5-CARBOXYLATE, 1,3-benzodioxol-5-ylmethyl 4-(4-ethylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate, 2H-benzo[d]1,3-dioxolan-5-ylmethyl 6-(4-ethylphenyl)-4-methyl-2-oxo-1,3,6-trih ydropyrimidine-5-carboxylate
| Molecular Formula | C22H22N2O5 |
|---|---|
| Molecular Weight | 394.15 g/mol |
| LogP | 3.349 |
| Topological Polar Surface Area | 85.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.15286 |
| Heavy Atoms | 29 |
| Complexity | 981.1972 |
Chemical Identifiers
| CAS Number | 347353-62-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C2C(=C(NC(=O)N2)C)C(=O)OCC3=CC4=C(C=C3)OCO4 |
Product Overview
VU0061059-1 (CAS 347353-62-2), with molecular formula C22H22N2O5 and molecular weight 394.15 g/mol. IUPAC: 1,3-benzodioxol-5-ylmethyl 4-(4-ethylphenyl)-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of VU0061059-1
Property Insights of VU0061059-1
The XLogP value of 3.349 indicates that VU0061059-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.89 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0061059-1. Following Lipinski's Rule of Five, VU0061059-1 has 2 hydrogen bond donor(s) and 5 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 VU0061059-1?
The CAS number of VU0061059-1 is 347353-62-2.
What is the molecular formula of VU0061059-1?
The molecular formula of VU0061059-1 is C22H22N2O5.
What is the molecular weight of VU0061059-1?
The molecular weight of VU0061059-1 is 394.15 g/mol.
Where can I buy VU0061059-1?
You can request a quote for VU0061059-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0061059-1?
Yes, KEHONG BIO provides custom synthesis services for VU0061059-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.