ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
TL;DR: ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate (CAS 372174-17-9) is a chemical compound with molecular formula C24H22N2O3S and molecular weight 418.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C24H22N2O3S |
|---|---|
| Molecular Weight | 418.14 g/mol |
| LogP | 4.3416 |
| Topological Polar Surface Area | 59.59 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.1351 |
| Heavy Atoms | 30 |
| Complexity | 1141.656 |
Chemical Identifiers
| CAS Number | 372174-17-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=C(C=CC3=CC=CC=C32)OC)C4=CC=CC=C4 |
Product Overview
ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate (CAS 372174-17-9), with molecular formula C24H22N2O3S and molecular weight 418.14 g/mol. IUPAC: ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Property Insights of ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
The XLogP value of 4.3416 indicates that ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.59 Ų, ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate has 2 hydrogen bond donor(s) and 4 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 ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
The CAS number of ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate is 372174-17-9.
What is the molecular formula of ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
The molecular formula of ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate is C24H22N2O3S.
What is the molecular weight of ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
The molecular weight of ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate is 418.14 g/mol.
Where can I buy ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
You can request a quote for ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-(2-methoxynaphthalen-1-yl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.