VU0508764-1
TL;DR: VU0508764-1 (CAS 1042069-96-4) is a chemical compound with molecular formula C20H24BrN3O5S and molecular weight 497.062 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
oxolan-2-ylmethyl 2-[1-[(3-bromo-4-methylbenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate
Also Known As: VU0508764-1, (tetrahydrofuran-2-yl)methyl 2-(1-((3-bromo-4-methylbenzoyl)carbamothioyl)-3-oxopiperazin-2-yl)acetate, oxolan-2-ylmethyl 2-[1-[(3-bromo-4-methylbenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate, F3087-4670, (oxolan-2-yl)methyl 2-(1-{[(3-bromo-4-methylphenyl)formamido]methanethioyl}-3-oxopiperazin-2-yl)acetate
Technical Specifications
| Molecular Formula | C20H24BrN3O5S |
| Molecular Weight | 497.062 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 497.062 Da |
| Heavy Atoms | 30 |
| Complexity | 679.0 |
| SMILES | CC1=C(C=C(C=C1)C(=O)NC(=S)N2CCNC(=O)C2CC(=O)OCC3CCCO3)Br |
| InChIKey | FUXGJFZGKPOBHX-UHFFFAOYSA-N |
Chemical Property Profile of VU0508764-1
Property Insights of VU0508764-1
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0508764-1. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0508764-1. Following Lipinski's Rule of Five, VU0508764-1 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of VU0508764-1?
The CAS number of VU0508764-1 is 1042069-96-4.
What is the molecular formula of VU0508764-1?
The molecular formula of VU0508764-1 is C20H24BrN3O5S.
What is the molecular weight of VU0508764-1?
The molecular weight of VU0508764-1 is 497.062 g/mol.
Where can I buy VU0508764-1?
You can request a quote for VU0508764-1 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for VU0508764-1?
Yes, CoreyChem provides custom synthesis services for VU0508764-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.