TL;DR: 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide (CAS 1004053-26-2) is a chemical compound with molecular formula C17H12N4O3S and molecular weight 352.06302 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2,5-dioxopyrrolidin-1-yl)-N-thieno[2,3-d]pyrimidin-4-ylbenzamide
Also Known As: F2733-0061, 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide
| Molecular Formula | C17H12N4O3S |
| Molecular Weight | 352.06302 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 121.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.06302 Da |
| Heavy Atoms | 25 |
| Complexity | 556.0 |
| SMILES | C1CC(=O)N(C1=O)C2=CC=CC(=C2)C(=O)NC3=C4C=CSC4=NC=N3 |
| InChIKey | QXDXPTKVILDFRY-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide. Following Lipinski's Rule of Five, 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide is 1004053-26-2.
The molecular formula of 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide is C17H12N4O3S.
The molecular weight of 3-(2,5-dioxopyrrolidin-1-yl)-N-(thieno[2,3-d]pyrimidin-4-yl)benzamide is 352.06302 g/mol.
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