TL;DR: 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene (CAS 166888-26-2) is a chemical compound with molecular formula C14H10BrNO2S and molecular weight 334.96155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[5-(bromomethyl)thiophen-2-yl]methyl]isoindole-1,3-dione
Also Known As: 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene, 2-[[5-(bromomethyl)thiophen-2-yl]methyl]isoindole-1,3-dione, N-((5-(bromomethyl)-2-thienyl)methyl)phthalimide, 2-((5-(Bromomethyl)thiophen-2-yl)methyl)isoindoline-1,3-dione, 2-{[5-(bromomethyl)thiophen-2-yl]methyl}-2,3-dihydro-1H-isoindole-1,3-dione
| Molecular Formula | C14H10BrNO2S |
| Molecular Weight | 334.96155 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.96155 Da |
| Heavy Atoms | 19 |
| Complexity | 366.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=CC=C(S3)CBr |
| InChIKey | FHZITBUKQUYRFS-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene. Following Lipinski's Rule of Five, 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene is 166888-26-2.
The molecular formula of 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene is C14H10BrNO2S.
The molecular weight of 2-(Bromomethyl)-5-(phthalimidomethyl)thiophene is 334.96155 g/mol.
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