tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(1,3-thiazol-2-yl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(1,3-thiazol-2-yl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(1,3-thiazol-2-yl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate
Compound characteristics
| Compound ID: | E955-0401 |
| Compound Name: | tert-butyl 4-{1-(3,4-dimethylphenyl)-4-[(1,3-thiazol-2-yl)carbamoyl]-1H-pyrazol-5-yl}piperidine-1-carboxylate |
| Molecular Weight: | 481.62 |
| Molecular Formula: | C25 H31 N5 O3 S |
| Smiles: | Cc1ccc(cc1C)n1c(C2CCN(CC2)C(=O)OC(C)(C)C)c(cn1)C(Nc1nccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3422 |
| logD: | 6.3313 |
| logSw: | -5.345 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.713 |
| InChI Key: | QNXYVFGNSVBUDB-UHFFFAOYSA-N |