VU0613091-1
TL;DR: VU0613091-1 (CAS 902041-91-2) is a chemical compound with molecular formula C18H12F3N7OS and molecular weight 431.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-quinoxalin-6-yl-2-[1-[2-(trifluoromethyl)phenyl]tetrazol-5-yl]sulfanylacetamide
Also Known As: VU0613091-1, AB01310123-01, F3375-1981, N-(quinoxalin-6-yl)-2-({1-[2-(trifluoromethyl)phenyl]-1H-1,2,3,4-tetrazol-5-yl}sulfanyl)acetamide, N-(quinoxalin-6-yl)-2-({1-[2-(trifluoromethyl)phenyl]-1H-tetrazol-5-yl}sulfanyl)acetamide
| Molecular Formula | C18H12F3N7OS |
|---|---|
| Molecular Weight | 431.08 g/mol |
| LogP | 3.3551 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.0776 |
| Heavy Atoms | 30 |
| Complexity | 1211.587 |
Chemical Identifiers
| CAS Number | 902041-91-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)N2C(=NN=N2)SCC(=O)NC3=CC4=NC=CN=C4C=C3 |
Product Overview
VU0613091-1 (CAS 902041-91-2), with molecular formula C18H12F3N7OS and molecular weight 431.08 g/mol. IUPAC: N-quinoxalin-6-yl-2-[1-[2-(trifluoromethyl)phenyl]tetrazol-5-yl]sulfanylacetamide.
Chemical Property Profile of VU0613091-1
Property Insights of VU0613091-1
The XLogP value of 3.3551 indicates that VU0613091-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0613091-1. Following Lipinski's Rule of Five, VU0613091-1 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 VU0613091-1?
The CAS number of VU0613091-1 is 902041-91-2.
What is the molecular formula of VU0613091-1?
The molecular formula of VU0613091-1 is C18H12F3N7OS.
What is the molecular weight of VU0613091-1?
The molecular weight of VU0613091-1 is 431.08 g/mol.
Where can I buy VU0613091-1?
You can request a quote for VU0613091-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0613091-1?
Yes, KEHONG BIO provides custom synthesis services for VU0613091-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.