TL;DR: ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate (CAS 1025009-24-8) is a chemical compound with molecular formula C22H18N2O4S2 and molecular weight 438.0708 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate
Also Known As: ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate, AB00675717-01, F1711-0208, ethyl 2-((2,4-dioxo-3-phenylthiazolidin-5-yl)amino)-4-phenylthiophene-3-carboxylate, ethyl 2-(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-ylamino)-4-phenyl-3-thenoate
| Molecular Formula | C22H18N2O4S2 |
| Molecular Weight | 438.0708 g/mol |
| XLogP | 6.0 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 438.0708 Da |
| Heavy Atoms | 30 |
| Complexity | 649.0 |
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC3C(=O)N(C(=O)S3)C4=CC=CC=C4 |
| InChIKey | PBBMYWUTIMTANX-UHFFFAOYSA-N |
The XLogP value of 6.0 indicates that ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate. Following Lipinski's Rule of Five, ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate is 1025009-24-8.
The molecular formula of ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate is C22H18N2O4S2.
The molecular weight of ethyl 2-[(2,4-dioxo-3-phenyl-1,3-thiazolidin-5-yl)amino]-4-phenylthiophene-3-carboxylate is 438.0708 g/mol.
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