Oprea1_725432
4-[(2-bromophenoxy)methyl]-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)benzamide
Also Known As: Oprea1_725432|AK-968/41171414|4-[(2-bromophenoxy)methyl]-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)benzamide|4-[(2-bromophenoxy)methyl]-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-3(4H)-yl)benzamide|4-[(2-BROMOPHENOXY)METHYL]-N-[2-METHYL-4-OXO-5,6,7,8-TETRAHYDRO[1]BENZOTHIENO[2,3-D]PYRIMIDIN-3(4H)-YL]BENZAMIDE
| Molecular Formula | C25H22BrN3O3S |
|---|---|
| Molecular Weight | 523.0565 g/mol |
| LogP | 5.37062 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 523.0565 |
| Monoisotopic Mass | 523.0565 |
| Heavy Atoms | 33 |
| Complexity | 1409.1824 |
Chemical Identifiers
| CAS Number | 438227-91-9 |
|---|---|
| SMILES | CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1NC(=O)C4=CC=C(C=C4)COC5=CC=CC=C5Br |
Product Overview
Oprea1_725432 (CAS 438227-91-9), with molecular formula C25H22BrN3O3S and molecular weight 523.0565 g/mol. IUPAC: 4-[(2-bromophenoxy)methyl]-N-(2-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)benzamide.
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