RefChem:813198
TL;DR: RefChem:813198 (CAS 618075-81-3) is a chemical compound with molecular formula C27H25FN2O7S and molecular weight 540.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3E)-2-(4-ethoxy-3-methoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: SALOR-INT L429899-1EA, Methyl 2-(2-(4-ethoxy-3-methoxyphenyl)-3-(3-fluoro-4-methylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate, 645-791-9, METHYL 2-(2-(4-ETHOXY-3-METHOXYPHENYL)-3-(3-FLUORO-4-METHYLBENZOYL)-4-HYDROXY-5-OXO-2,5-DIHYDRO-1H-PYRROL-1-YL)-4-METHYL-1,3-THIAZOLE-5-CARBOXYLATE, methyl 2-[2-(4-ethoxy-3-methoxyphenyl)-3-(3-fluoro-4-methylbenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C27H25FN2O7S |
|---|---|
| Molecular Weight | 540.14 g/mol |
| LogP | 4.71924 |
| Topological Polar Surface Area | 115.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 540.13666 |
| Heavy Atoms | 38 |
| Complexity | 1480.0493 |
Chemical Identifiers
| CAS Number | 618075-81-3 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC(=C(C=C3)C)F)\O)/C(=O)C(=O)N2C4=NC(=C(S4)C(=O)OC)C)OC |
Product Overview
RefChem:813198 (CAS 618075-81-3), with molecular formula C27H25FN2O7S and molecular weight 540.14 g/mol. IUPAC: methyl 2-[(3E)-2-(4-ethoxy-3-methoxyphenyl)-3-[(3-fluoro-4-methylphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of RefChem:813198
Property Insights of RefChem:813198
The XLogP value of 4.71924 indicates that RefChem:813198 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.26 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:813198. Following Lipinski's Rule of Five, RefChem:813198 has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:813198?
The CAS number of RefChem:813198 is 618075-81-3.
What is the molecular formula of RefChem:813198?
The molecular formula of RefChem:813198 is C27H25FN2O7S.
What is the molecular weight of RefChem:813198?
The molecular weight of RefChem:813198 is 540.14 g/mol.
Where can I buy RefChem:813198?
You can request a quote for RefChem:813198 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:813198?
Yes, KEHONG BIO provides custom synthesis services for RefChem:813198 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.