4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)
TL;DR: 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) (CAS 155346-64-8) is a chemical compound with molecular formula C26H31N3O7S and molecular weight 529.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[2-(4-benzhydrylpiperazin-1-yl)acetyl]-1,3-thiazolidine-4-carboxylate;oxalic acid
Also Known As: 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1), Methyl 3-[2-(4-benzhydrylpiperazin-1-yl)acetyl]-1,3-thiazolidine-4-carboxylate; Oxalic Acid, Oxalic acid--methyl 3-{[4-(diphenylmethyl)piperazin-1-yl]acetyl}-1,3-thiazolidine-4-carboxylate (1/1), RefChem:296561
| Molecular Formula | C26H31N3O7S |
|---|---|
| Molecular Weight | 529.19 g/mol |
| LogP | 1.6237 |
| Topological Polar Surface Area | 127.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 529.1883 |
| Heavy Atoms | 37 |
| Complexity | 1010.8547 |
Chemical Identifiers
| CAS Number | 155346-64-8 |
|---|---|
| SMILES | COC(=O)C1CSCN1C(=O)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4.C(=O)(C(=O)O)O |
Product Overview
4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) (CAS 155346-64-8), with molecular formula C26H31N3O7S and molecular weight 529.19 g/mol. IUPAC: methyl 3-[2-(4-benzhydrylpiperazin-1-yl)acetyl]-1,3-thiazolidine-4-carboxylate;oxalic acid.
Chemical Property Profile of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)
Property Insights of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)
The XLogP value of 1.6237 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1). The TPSA of 127.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1). Following Lipinski's Rule of Five, 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)?
The CAS number of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) is 155346-64-8.
What is the molecular formula of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)?
The molecular formula of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) is C26H31N3O7S.
What is the molecular weight of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)?
The molecular weight of 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) is 529.19 g/mol.
Where can I buy 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)?
You can request a quote for 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 4-Thiazolidinecarboxylic acid, 3-((4-(diphenylmethyl)-1-piperazinyl)acetyl)-, methyl ester, ethanedioate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.