5-chloro-3,6-dimethyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-chloro-3,6-dimethyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
5-chloro-3,6-dimethyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D491-9962 |
| Compound Name: | 5-chloro-3,6-dimethyl-N-{1-[(4-methylphenyl)methyl]-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 393.87 |
| Molecular Formula: | C22 H20 Cl N3 O2 |
| Smiles: | [H]N(C(c1c(C)c2cc(c(C)cc2o1)[Cl])=O)c1ccnn1Cc1ccc(C)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.9462 |
| logD: | 5.9458 |
| logSw: | -6.1516 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.289 |
| InChI Key: | GHKCCHGVLRUHRS-UHFFFAOYSA-N |