VU0507939-1
TL;DR: VU0507939-1 (CAS 714262-72-3) is a chemical compound with molecular formula C22H22N2O6S and molecular weight 442.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[3-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate
Also Known As: VU0507939-1, F3048-0088, METHYL 4-[3-({[(4-ETHOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-2,5-DIOXOPYRROLIDIN-1-YL]BENZOATE, methyl 4-(3-((2-((4-ethoxyphenyl)amino)-2-oxoethyl)thio)-2,5-dioxopyrrolidin-1-yl)benzoate, methyl 4-[3-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate
| Molecular Formula | C22H22N2O6S |
|---|---|
| Molecular Weight | 442.12 g/mol |
| LogP | 2.8757 |
| Topological Polar Surface Area | 102.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 442.11984 |
| Heavy Atoms | 31 |
| Complexity | 974.50055 |
Chemical Identifiers
| CAS Number | 714262-72-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)NC(=O)CSC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC |
Product Overview
VU0507939-1 (CAS 714262-72-3), with molecular formula C22H22N2O6S and molecular weight 442.12 g/mol. IUPAC: methyl 4-[3-[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate.
Chemical Property Profile of VU0507939-1
Property Insights of VU0507939-1
The XLogP value of 2.8757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0507939-1. The TPSA of 102.01 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0507939-1. Following Lipinski's Rule of Five, VU0507939-1 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 VU0507939-1?
The CAS number of VU0507939-1 is 714262-72-3.
What is the molecular formula of VU0507939-1?
The molecular formula of VU0507939-1 is C22H22N2O6S.
What is the molecular weight of VU0507939-1?
The molecular weight of VU0507939-1 is 442.12 g/mol.
Where can I buy VU0507939-1?
You can request a quote for VU0507939-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0507939-1?
Yes, KEHONG BIO provides custom synthesis services for VU0507939-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.