VU0508760-1
TL;DR: VU0508760-1 (CAS 1043503-36-1) is a chemical compound with molecular formula C19H22N4O7S and molecular weight 450.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 2-[1-[(3-nitrobenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate
Also Known As: VU0508760-1, F3087-4648, (tetrahydrofuran-2-yl)methyl 2-(1-((3-nitrobenzoyl)carbamothioyl)-3-oxopiperazin-2-yl)acetate, oxolan-2-ylmethyl 2-[1-[(3-nitrobenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate, (oxolan-2-yl)methyl 2-(1-{[(3-nitrophenyl)formamido]methanethioyl}-3-oxopiperazin-2-yl)acetate
| Molecular Formula | C19H22N4O7S |
|---|---|
| Molecular Weight | 450.12 g/mol |
| LogP | 0.5222 |
| Topological Polar Surface Area | 140.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 450.1209 |
| Heavy Atoms | 31 |
| Complexity | 887.7622 |
Chemical Identifiers
| CAS Number | 1043503-36-1 |
|---|---|
| SMILES | C1CC(OC1)COC(=O)CC2C(=O)NCCN2C(=S)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
VU0508760-1 (CAS 1043503-36-1), with molecular formula C19H22N4O7S and molecular weight 450.12 g/mol. IUPAC: oxolan-2-ylmethyl 2-[1-[(3-nitrobenzoyl)carbamothioyl]-3-oxopiperazin-2-yl]acetate.
Chemical Property Profile of VU0508760-1
Property Insights of VU0508760-1
The XLogP value of 0.5222 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0508760-1. The TPSA of 140.11 Ų indicates high polarity, suggesting VU0508760-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, VU0508760-1 has 2 hydrogen bond donor(s) and 8 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 VU0508760-1?
The CAS number of VU0508760-1 is 1043503-36-1.
What is the molecular formula of VU0508760-1?
The molecular formula of VU0508760-1 is C19H22N4O7S.
What is the molecular weight of VU0508760-1?
The molecular weight of VU0508760-1 is 450.12 g/mol.
Where can I buy VU0508760-1?
You can request a quote for VU0508760-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0508760-1?
Yes, KEHONG BIO provides custom synthesis services for VU0508760-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.