N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-4-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-4-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | C883-0803 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazole-4-carbonyl]piperidine-4-carboxamide |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C28 H27 N5 O4 |
| Smiles: | C1CN(CCC1C(Nc1ccc2c(c1)OCCO2)=O)C(c1cnn(c2ccccc2)c1n1cccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8889 |
| logD: | 2.8887 |
| logSw: | -3.3249 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.658 |
| InChI Key: | MNHMVNSOAZOINK-UHFFFAOYSA-N |