tert-butyl 4-[4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-(2,6-dimethylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-(2,6-dimethylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
tert-butyl 4-[4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-(2,6-dimethylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-1890 |
| Compound Name: | tert-butyl 4-[4-{[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}-1-(2,6-dimethylphenyl)-1H-pyrazol-5-yl]piperidine-1-carboxylate |
| Molecular Weight: | 532.64 |
| Molecular Formula: | C30 H36 N4 O5 |
| Smiles: | Cc1cccc(C)c1n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5357 |
| logD: | 6.5357 |
| logSw: | -5.5568 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.07 |
| InChI Key: | IKGQZAFOOIOTHN-UHFFFAOYSA-N |