5-chloro-N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-3,6-dimethyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-chloro-N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-3,6-dimethyl-1-benzofuran-2-carboxamide
5-chloro-N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-3,6-dimethyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D492-0004 |
| Compound Name: | 5-chloro-N-{1-[(4-methoxyphenyl)methyl]-1H-pyrazol-5-yl}-3,6-dimethyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 409.87 |
| Molecular Formula: | C22 H20 Cl N3 O3 |
| Smiles: | [H]N(C(c1c(C)c2cc(c(C)cc2o1)[Cl])=O)c1ccnn1Cc1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 5.5052 |
| logD: | 5.5048 |
| logSw: | -6.0062 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.832 |
| InChI Key: | DEDPXPHRMNQLLI-UHFFFAOYSA-N |