5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]furan-2-carboxamide
5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]furan-2-carboxamide
Compound characteristics
| Compound ID: | 6228-2590 |
| Compound Name: | 5-[(4-bromo-1H-pyrazol-1-yl)methyl]-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]furan-2-carboxamide |
| Molecular Weight: | 481.34 |
| Molecular Formula: | C17 H13 Br N4 O4 S2 |
| Smiles: | CS(c1ccc2c(c1)sc(NC(c1ccc(Cn3cc(cn3)[Br])o1)=O)n2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8126 |
| logD: | 2.8114 |
| logSw: | -3.4641 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.187 |
| InChI Key: | VQVAAPMMJIWOGB-UHFFFAOYSA-N |