VU0495786-1
TL;DR: VU0495786-1 (CAS 899995-86-9) is a chemical compound with molecular formula C19H19N3O6S and molecular weight 417.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl]-1,1-dioxo-1,2-benzothiazol-3-one
Also Known As: VU0495786-1, F2749-0051, 2-[3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl]-1,1-dioxo-1,2-benzothiazol-3-one, 2-(3-(4-(furan-2-carbonyl)piperazin-1-yl)-3-oxopropyl)benzo[d]isothiazol-3(2H)-one 1,1-dioxide, 2-{3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl}-2,3-dihydro-1lambda6,2-benzothiazole-1,1,3-trione
| Molecular Formula | C19H19N3O6S |
|---|---|
| Molecular Weight | 417.10 g/mol |
| LogP | 0.7988 |
| Topological Polar Surface Area | 108.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 417.09946 |
| Heavy Atoms | 29 |
| Complexity | 1055.3734 |
Chemical Identifiers
| CAS Number | 899995-86-9 |
|---|---|
| SMILES | C1CN(CCN1C(=O)CCN2C(=O)C3=CC=CC=C3S2(=O)=O)C(=O)C4=CC=CO4 |
Product Overview
VU0495786-1 (CAS 899995-86-9), with molecular formula C19H19N3O6S and molecular weight 417.10 g/mol. IUPAC: 2-[3-[4-(furan-2-carbonyl)piperazin-1-yl]-3-oxopropyl]-1,1-dioxo-1,2-benzothiazol-3-one.
Chemical Property Profile of VU0495786-1
Property Insights of VU0495786-1
The XLogP value of 0.7988 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0495786-1. The TPSA of 108.21 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0495786-1. Following Lipinski's Rule of Five, VU0495786-1 has 0 hydrogen bond donor(s) and 6 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 VU0495786-1?
The CAS number of VU0495786-1 is 899995-86-9.
What is the molecular formula of VU0495786-1?
The molecular formula of VU0495786-1 is C19H19N3O6S.
What is the molecular weight of VU0495786-1?
The molecular weight of VU0495786-1 is 417.10 g/mol.
Where can I buy VU0495786-1?
You can request a quote for VU0495786-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0495786-1?
Yes, KEHONG BIO provides custom synthesis services for VU0495786-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.