VU0499666-1
TL;DR: VU0499666-1 (CAS 899749-38-3) is a chemical compound with molecular formula C18H21N3O6S and molecular weight 407.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate
Also Known As: VU0499666-1, F2800-0041, ethyl 4-((2-((3,4-dimethoxyphenyl)amino)-2-oxoethyl)thio)-6-methyl-2-oxo-1,2-dihydropyrimidine-5-carboxylate, ethyl 4-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate, ethyl 4-({[(3,4-dimethoxyphenyl)carbamoyl]methyl}sulfanyl)-6-methyl-2-oxo-1,2-dihydropyrimidine-5-carboxylate
| Molecular Formula | C18H21N3O6S |
|---|---|
| Molecular Weight | 407.12 g/mol |
| LogP | 2.00302 |
| Topological Polar Surface Area | 119.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 407.1151 |
| Heavy Atoms | 28 |
| Complexity | 928.02234 |
Chemical Identifiers
| CAS Number | 899749-38-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=O)N=C1SCC(=O)NC2=CC(=C(C=C2)OC)OC)C |
Product Overview
VU0499666-1 (CAS 899749-38-3), with molecular formula C18H21N3O6S and molecular weight 407.12 g/mol. IUPAC: ethyl 4-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of VU0499666-1
Property Insights of VU0499666-1
The XLogP value of 2.00302 suggests moderate lipophilicity, balancing water solubility and membrane permeability for VU0499666-1. The TPSA of 119.61 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0499666-1. Following Lipinski's Rule of Five, VU0499666-1 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 VU0499666-1?
The CAS number of VU0499666-1 is 899749-38-3.
What is the molecular formula of VU0499666-1?
The molecular formula of VU0499666-1 is C18H21N3O6S.
What is the molecular weight of VU0499666-1?
The molecular weight of VU0499666-1 is 407.12 g/mol.
Where can I buy VU0499666-1?
You can request a quote for VU0499666-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0499666-1?
Yes, KEHONG BIO provides custom synthesis services for VU0499666-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.