(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)methanone
Chemical Structure Depiction of
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)methanone
(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)methanone
Compound characteristics
| Compound ID: | E009-0026 |
| Compound Name: | (1,4-dioxa-8-azaspiro[4.5]decan-8-yl)(1-{[1-phenyl-5-(1H-pyrrol-1-yl)-1H-pyrazol-4-yl]methyl}piperidin-4-yl)methanone |
| Molecular Weight: | 475.59 |
| Molecular Formula: | C27 H33 N5 O3 |
| Smiles: | C1CN(CCC1C(N1CCC2(CC1)OCCO2)=O)Cc1cnn(c2ccccc2)c1n1cccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9197 |
| logD: | -0.7401 |
| logSw: | -2.8617 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.913 |
| InChI Key: | NKBUYLFCTGVVKN-UHFFFAOYSA-N |