N-cycloheptyl-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
N-cycloheptyl-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide
N-cycloheptyl-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-0391 |
| Compound Name: | N-cycloheptyl-4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-5-methyl-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C18 H25 N5 O4 |
| Smiles: | Cc1c(c(C)n(Cc2c(C(NC3CCCCCC3)=O)noc2C)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6333 |
| logD: | 2.6333 |
| logSw: | -2.6854 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.001 |
| InChI Key: | QWHJSVKCXFRGJA-UHFFFAOYSA-N |