N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}cyclobutanecarboxamide
Chemical Structure Depiction of
N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}cyclobutanecarboxamide
N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}cyclobutanecarboxamide
Compound characteristics
| Compound ID: | V011-8302 |
| Compound Name: | N-{4-[5-(2H-1,3-benzodioxol-5-yl)-3-(2-methylpropoxy)-1H-1,2,4-triazol-1-yl]phenyl}cyclobutanecarboxamide |
| Molecular Weight: | 434.49 |
| Molecular Formula: | C24 H26 N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)COc1nc(c2ccc3c(c2)OCO3)n(c2ccc(cc2)NC(C2CCC2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5821 |
| logD: | 4.582 |
| logSw: | -4.3568 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.919 |
| InChI Key: | AAZCPUZHPPZWLV-UHFFFAOYSA-N |