F1038-0276
TL;DR: F1038-0276 (CAS 500148-85-6) is a chemical compound with molecular formula C28H28N2O4S and molecular weight 488.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 4-(3-ethoxy-4-phenylmethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: F1038-0276, benzyl 4-(4-(benzyloxy)-3-ethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, benzyl 4-[4-(benzyloxy)-3-ethoxyphenyl]-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate, benzyl 4-(3-ethoxy-4-phenylmethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
| Molecular Formula | C28H28N2O4S |
|---|---|
| Molecular Weight | 488.18 g/mol |
| LogP | 5.2005 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 488.17697 |
| Heavy Atoms | 35 |
| Complexity | 1212.1416 |
Chemical Identifiers
| CAS Number | 500148-85-6 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2C(=C(NC(=S)N2)C)C(=O)OCC3=CC=CC=C3)OCC4=CC=CC=C4 |
Product Overview
F1038-0276 (CAS 500148-85-6), with molecular formula C28H28N2O4S and molecular weight 488.18 g/mol. IUPAC: benzyl 4-(3-ethoxy-4-phenylmethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of F1038-0276
Property Insights of F1038-0276
The XLogP value of 5.2005 indicates that F1038-0276 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for F1038-0276. Following Lipinski's Rule of Five, F1038-0276 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F1038-0276?
The CAS number of F1038-0276 is 500148-85-6.
What is the molecular formula of F1038-0276?
The molecular formula of F1038-0276 is C28H28N2O4S.
What is the molecular weight of F1038-0276?
The molecular weight of F1038-0276 is 488.18 g/mol.
Where can I buy F1038-0276?
You can request a quote for F1038-0276 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1038-0276?
Yes, KEHONG BIO provides custom synthesis services for F1038-0276 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.