![4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate structure](/static/products/920/920807-79-0.png)
4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
TL;DR: 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate (CAS 920807-79-0) is a chemical compound with molecular formula C22H23N3O5S and molecular weight 441.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
Also Known As: 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate, 4-Methyl 2-({2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl}methyl) 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
| Molecular Formula | C22H23N3O5S |
|---|---|
| Molecular Weight | 441.14 g/mol |
| LogP | 3.72126 |
| Topological Polar Surface Area | 110.38 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.13583 |
| Heavy Atoms | 31 |
| Complexity | 1132.1224 |
Chemical Identifiers
| CAS Number | 920807-79-0 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CC2=NC(=CS2)COC(=O)C3=C(C(=C(N3)C)C(=O)OC)C |
Product Overview
4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate (CAS 920807-79-0), with molecular formula C22H23N3O5S and molecular weight 441.14 g/mol. IUPAC: 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate.
Chemical Property Profile of 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
Property Insights of 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate
The XLogP value of 3.72126 indicates that 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.38 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate. Following Lipinski's Rule of Five, 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate has 2 hydrogen bond donor(s) and 7 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 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate?
The CAS number of 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate is 920807-79-0.
What is the molecular formula of 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate?
The molecular formula of 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate is C22H23N3O5S.
What is the molecular weight of 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate?
The molecular weight of 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate is 441.14 g/mol.
Where can I buy 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate?
You can request a quote for 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 4-O-methyl 2-O-[[2-[2-(2-methylanilino)-2-oxoethyl]-1,3-thiazol-4-yl]methyl] 3,5-dimethyl-1H-pyrrole-2,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.