VU0507610-1
TL;DR: VU0507610-1 (CAS 831177-63-0) is a chemical compound with molecular formula C16H10ClN3O6S and molecular weight 407.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(4-chloro-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid
Also Known As: VU0507610-1, AB00689044-01, F3023-0308, AS-871/43476039, 2-{[1-(4-chloro-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl}pyridine-3-carboxylic acid
| Molecular Formula | C16H10ClN3O6S |
|---|---|
| Molecular Weight | 407.00 g/mol |
| LogP | 2.7656 |
| Topological Polar Surface Area | 130.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 406.9979 |
| Heavy Atoms | 27 |
| Complexity | 982.378 |
Chemical Identifiers
| CAS Number | 831177-63-0 |
|---|---|
| SMILES | C1C(C(=O)N(C1=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])SC3=C(C=CC=N3)C(=O)O |
Product Overview
VU0507610-1 (CAS 831177-63-0), with molecular formula C16H10ClN3O6S and molecular weight 407.00 g/mol. IUPAC: 2-[1-(4-chloro-2-nitrophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylpyridine-3-carboxylic acid.
Chemical Property Profile of VU0507610-1
Property Insights of VU0507610-1
The XLogP value of 2.7656 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0507610-1. The TPSA of 130.71 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0507610-1. Following Lipinski's Rule of Five, VU0507610-1 has 1 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 VU0507610-1?
The CAS number of VU0507610-1 is 831177-63-0.
What is the molecular formula of VU0507610-1?
The molecular formula of VU0507610-1 is C16H10ClN3O6S.
What is the molecular weight of VU0507610-1?
The molecular weight of VU0507610-1 is 407.00 g/mol.
Where can I buy VU0507610-1?
You can request a quote for VU0507610-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0507610-1?
Yes, KEHONG BIO provides custom synthesis services for VU0507610-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.