F1038-0286
TL;DR: F1038-0286 (CAS 306957-95-9) is a chemical compound with molecular formula C21H20N2O4S and molecular weight 396.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-benzoyloxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: F1038-0286, ethyl 4-[4-(benzoyloxy)phenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 4-(4-(benzoyloxy)phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, ethyl 4-(4-benzoyloxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C21H20N2O4S |
|---|---|
| Molecular Weight | 396.11 g/mol |
| LogP | 3.2617 |
| Topological Polar Surface Area | 76.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.11438 |
| Heavy Atoms | 28 |
| Complexity | 923.1816 |
Chemical Identifiers
| CAS Number | 306957-95-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3)C |
Product Overview
F1038-0286 (CAS 306957-95-9), with molecular formula C21H20N2O4S and molecular weight 396.11 g/mol. IUPAC: ethyl 4-(4-benzoyloxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of F1038-0286
Property Insights of F1038-0286
The XLogP value of 3.2617 indicates that F1038-0286 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.66 Ų falls within the moderate polarity range, balancing permeability and solubility for F1038-0286. Following Lipinski's Rule of Five, F1038-0286 has 2 hydrogen bond donor(s) and 5 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 F1038-0286?
The CAS number of F1038-0286 is 306957-95-9.
What is the molecular formula of F1038-0286?
The molecular formula of F1038-0286 is C21H20N2O4S.
What is the molecular weight of F1038-0286?
The molecular weight of F1038-0286 is 396.11 g/mol.
Where can I buy F1038-0286?
You can request a quote for F1038-0286 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1038-0286?
Yes, KEHONG BIO provides custom synthesis services for F1038-0286 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.