VU0507977-1
TL;DR: VU0507977-1 (CAS 956790-55-9) is a chemical compound with molecular formula C20H18F3N3O2S and molecular weight 421.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(oxolan-2-ylmethyl)-4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide
Also Known As: VU0507977-1, AF-399/42928323, N-(oxolan-2-ylmethyl)-4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide, F3055-0060, N-[(oxolan-2-yl)methyl]-4-[5-(thiophen-2-yl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]benzamide
| Molecular Formula | C20H18F3N3O2S |
|---|---|
| Molecular Weight | 421.11 g/mol |
| LogP | 4.5284 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.10718 |
| Heavy Atoms | 29 |
| Complexity | 975.57263 |
Chemical Identifiers
| CAS Number | 956790-55-9 |
|---|---|
| SMILES | C1CC(OC1)CNC(=O)C2=CC=C(C=C2)N3C(=CC(=N3)C(F)(F)F)C4=CC=CS4 |
Product Overview
VU0507977-1 (CAS 956790-55-9), with molecular formula C20H18F3N3O2S and molecular weight 421.11 g/mol. IUPAC: N-(oxolan-2-ylmethyl)-4-[5-thiophen-2-yl-3-(trifluoromethyl)pyrazol-1-yl]benzamide.
Chemical Property Profile of VU0507977-1
Property Insights of VU0507977-1
The XLogP value of 4.5284 indicates that VU0507977-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.15 Ų, VU0507977-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0507977-1 has 1 hydrogen bond donor(s) and 4 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 VU0507977-1?
The CAS number of VU0507977-1 is 956790-55-9.
What is the molecular formula of VU0507977-1?
The molecular formula of VU0507977-1 is C20H18F3N3O2S.
What is the molecular weight of VU0507977-1?
The molecular weight of VU0507977-1 is 421.11 g/mol.
Where can I buy VU0507977-1?
You can request a quote for VU0507977-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0507977-1?
Yes, KEHONG BIO provides custom synthesis services for VU0507977-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.