N-[2-(azepan-1-yl)ethyl]-3-[1-(4-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-3-[1-(4-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
N-[2-(azepan-1-yl)ethyl]-3-[1-(4-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F386-2214 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-3-[1-(4-chlorophenyl)-3-methyl-1H-pyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 428.92 |
| Molecular Formula: | C21 H25 Cl N6 O2 |
| Smiles: | Cc1c(cn(c2ccc(cc2)[Cl])n1)c1nc(C(NCCN2CCCCCC2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.4976 |
| logD: | 1.8995 |
| logSw: | -3.9262 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.195 |
| InChI Key: | JBFGQFSHRBHHKF-UHFFFAOYSA-N |