tert-butyl 4-{6-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]-2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl}piperidine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-{6-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]-2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl}piperidine-1-carboxylate
tert-butyl 4-{6-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]-2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl}piperidine-1-carboxylate
Compound characteristics
Compound ID: | C614-5572 |
Compound Name: | tert-butyl 4-{6-[(2,3-dihydro-1,4-benzodioxin-6-yl)carbamoyl]-2-(4-ethoxyphenyl)pyrazolo[1,5-a]pyrimidin-5-yl}piperidine-1-carboxylate |
Molecular Weight: | 599.69 |
Molecular Formula: | C33 H37 N5 O6 |
Smiles: | CCOc1ccc(cc1)c1cc2nc(C3CCN(CC3)C(=O)OC(C)(C)C)c(cn2n1)C(Nc1ccc2c(c1)OCCO2)=O |
Stereo: | ACHIRAL |
logP: | 5.8056 |
logD: | 5.8033 |
logSw: | -5.323 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.281 |
InChI Key: | IKQGTBPSWXBVTH-UHFFFAOYSA-N |