VU0488587-1
TL;DR: VU0488587-1 (CAS 851810-79-2) is a chemical compound with molecular formula C19H22FN5O3S and molecular weight 419.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(4-fluorophenyl)-(6-hydroxy-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl)methyl]piperazine-1-carboxylate
Also Known As: VU0488587-1, AB00430917-05, F0631-0258, ethyl 4-[(4-fluorophenyl)-(6-hydroxy-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl)methyl]piperazine-1-carboxylate, 4-[(4-fluorophenyl)-(6-hydroxy-2-methyl-5-thiazolo[3,2-b][1,2,4]triazolyl)methyl]-1-piperazinecarboxylic acid ethyl ester
| Molecular Formula | C19H22FN5O3S |
|---|---|
| Molecular Weight | 419.14 g/mol |
| LogP | 2.80742 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.14273 |
| Heavy Atoms | 29 |
| Complexity | 1010.94836 |
Chemical Identifiers
| CAS Number | 851810-79-2 |
|---|---|
| SMILES | CCOC(=O)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=C(N4C(=NC(=N4)C)S3)O |
Product Overview
VU0488587-1 (CAS 851810-79-2), with molecular formula C19H22FN5O3S and molecular weight 419.14 g/mol. IUPAC: ethyl 4-[(4-fluorophenyl)-(6-hydroxy-2-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-5-yl)methyl]piperazine-1-carboxylate.
Chemical Property Profile of VU0488587-1
Property Insights of VU0488587-1
The XLogP value of 2.80742 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0488587-1. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0488587-1. Following Lipinski's Rule of Five, VU0488587-1 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 VU0488587-1?
The CAS number of VU0488587-1 is 851810-79-2.
What is the molecular formula of VU0488587-1?
The molecular formula of VU0488587-1 is C19H22FN5O3S.
What is the molecular weight of VU0488587-1?
The molecular weight of VU0488587-1 is 419.14 g/mol.
Where can I buy VU0488587-1?
You can request a quote for VU0488587-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0488587-1?
Yes, KEHONG BIO provides custom synthesis services for VU0488587-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.