VU0608754-1
TL;DR: VU0608754-1 (CAS 853891-85-7) is a chemical compound with molecular formula C17H13N5O2S and molecular weight 351.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: VU0608754-1, F3284-8656, 6-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(pyridin-4-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 4-[6-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-7-YL)-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-3-YL]PYRIDINE, 6-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C17H13N5O2S |
|---|---|
| Molecular Weight | 351.08 g/mol |
| LogP | 3.0761 |
| Topological Polar Surface Area | 74.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 351.079 |
| Heavy Atoms | 25 |
| Complexity | 1043.8218 |
Chemical Identifiers
| CAS Number | 853891-85-7 |
|---|---|
| SMILES | C1COC2=C(C=C(C=C2)C3=NN4C(=NN=C4S3)C5=CC=NC=C5)OC1 |
Product Overview
VU0608754-1 (CAS 853891-85-7), with molecular formula C17H13N5O2S and molecular weight 351.08 g/mol. IUPAC: 6-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of VU0608754-1
Property Insights of VU0608754-1
The XLogP value of 3.0761 indicates that VU0608754-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.43 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0608754-1. Following Lipinski's Rule of Five, VU0608754-1 has 0 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 VU0608754-1?
The CAS number of VU0608754-1 is 853891-85-7.
What is the molecular formula of VU0608754-1?
The molecular formula of VU0608754-1 is C17H13N5O2S.
What is the molecular weight of VU0608754-1?
The molecular weight of VU0608754-1 is 351.08 g/mol.
Where can I buy VU0608754-1?
You can request a quote for VU0608754-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0608754-1?
Yes, KEHONG BIO provides custom synthesis services for VU0608754-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.