RefChem:813320
TL;DR: RefChem:813320 (CAS 618073-37-3) is a chemical compound with molecular formula C32H36N2O8S and molecular weight 608.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[(3E)-2-(4-butoxy-3-methoxyphenyl)-3-[(4-butoxyphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: Methyl 2-(2-(4-butoxy-3-methoxyphenyl)-3-(4-butoxybenzoyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)-4-methylthiazole-5-carboxylate, 637-713-7, Methyl 2-(3-(4-butoxybenzoyl)-2-(4-butoxy-3-methoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-YL)-4-methyl-1,3-thiazole-5-carboxylate, methyl 2-[3-(4-butoxybenzoyl)-2-(4-butoxy-3-methoxyphenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate, RefChem:813320
| Molecular Formula | C32H36N2O8S |
|---|---|
| Molecular Weight | 608.22 g/mol |
| LogP | 6.23082 |
| Topological Polar Surface Area | 124.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 608.21924 |
| Heavy Atoms | 43 |
| Complexity | 1512.0055 |
Chemical Identifiers
| CAS Number | 618073-37-3 |
|---|---|
| SMILES | CCCCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=NC(=C(S3)C(=O)OC)C)C4=CC(=C(C=C4)OCCCC)OC)/O |
Product Overview
RefChem:813320 (CAS 618073-37-3), with molecular formula C32H36N2O8S and molecular weight 608.22 g/mol. IUPAC: methyl 2-[(3E)-2-(4-butoxy-3-methoxyphenyl)-3-[(4-butoxyphenyl)-hydroxymethylidene]-4,5-dioxopyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of RefChem:813320
Property Insights of RefChem:813320
The XLogP value of 6.23082 indicates that RefChem:813320 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.49 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:813320. Following Lipinski's Rule of Five, RefChem:813320 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:813320?
The CAS number of RefChem:813320 is 618073-37-3.
What is the molecular formula of RefChem:813320?
The molecular formula of RefChem:813320 is C32H36N2O8S.
What is the molecular weight of RefChem:813320?
The molecular weight of RefChem:813320 is 608.22 g/mol.
Where can I buy RefChem:813320?
You can request a quote for RefChem:813320 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:813320?
Yes, KEHONG BIO provides custom synthesis services for RefChem:813320 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.