N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-5-(propan-2-yl)-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-2957 |
| Compound Name: | N-{1-[(4-chlorophenyl)methyl]-5-methyl-1H-pyrazol-3-yl}-5-(propan-2-yl)-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 358.83 |
| Molecular Formula: | C18 H19 Cl N4 O2 |
| Smiles: | CC(C)c1cc(C(Nc2cc(C)n(Cc3ccc(cc3)[Cl])n2)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.1363 |
| logD: | 4.102 |
| logSw: | -4.388 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.632 |
| InChI Key: | LBCBQGSDTFMJOD-UHFFFAOYSA-N |