6-bromo-3-methyl-N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
6-bromo-3-methyl-N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
6-bromo-3-methyl-N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D492-0050 |
| Compound Name: | 6-bromo-3-methyl-N-{1-[(thiophen-2-yl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 416.29 |
| Molecular Formula: | C18 H14 Br N3 O2 S |
| Smiles: | [H]N(C(c1c(C)c2ccc(cc2o1)[Br])=O)c1ccnn1Cc1cccs1 |
| Stereo: | ACHIRAL |
| logP: | 4.7857 |
| logD: | 4.785 |
| logSw: | -4.635 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.307 |
| InChI Key: | PUQTYQZBWUHTTG-UHFFFAOYSA-N |