VU0513417-1
TL;DR: VU0513417-1 (CAS 898604-39-2) is a chemical compound with molecular formula C17H18N4O3S and molecular weight 358.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-ethoxyphenyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1,2-oxazole-3-carboxamide
Also Known As: VU0513417-1, F3216-1382, 5-(4-ethoxyphenyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1,2-oxazole-3-carboxamide, 5-(4-ethoxyphenyl)-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)isoxazole-3-carboxamide, 5-(4-ethoxyphenyl)-N-[5-(propan-2-yl)-1,3,4-thiadiazol-2-yl]-1,2-oxazole-3-carboxamide
| Molecular Formula | C17H18N4O3S |
|---|---|
| Molecular Weight | 358.11 g/mol |
| LogP | 3.9675 |
| Topological Polar Surface Area | 90.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 358.10995 |
| Heavy Atoms | 25 |
| Complexity | 854.9174 |
Chemical Identifiers
| CAS Number | 898604-39-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC3=NN=C(S3)C(C)C |
Product Overview
VU0513417-1 (CAS 898604-39-2), with molecular formula C17H18N4O3S and molecular weight 358.11 g/mol. IUPAC: 5-(4-ethoxyphenyl)-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-1,2-oxazole-3-carboxamide.
Chemical Property Profile of VU0513417-1
Property Insights of VU0513417-1
The XLogP value of 3.9675 indicates that VU0513417-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.14 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0513417-1. Following Lipinski's Rule of Five, VU0513417-1 has 1 hydrogen bond donor(s) and 7 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 VU0513417-1?
The CAS number of VU0513417-1 is 898604-39-2.
What is the molecular formula of VU0513417-1?
The molecular formula of VU0513417-1 is C17H18N4O3S.
What is the molecular weight of VU0513417-1?
The molecular weight of VU0513417-1 is 358.11 g/mol.
Where can I buy VU0513417-1?
You can request a quote for VU0513417-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0513417-1?
Yes, KEHONG BIO provides custom synthesis services for VU0513417-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.