2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]piperidin-1-yl}ethan-1-one
2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S897-0091 |
| Compound Name: | 2-(3,5-dimethyl-1H-pyrazol-1-yl)-1-{4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C22 H31 N5 O3 |
| Smiles: | CCc1nc2CCOCCc2c(n1)OC1CCN(CC1)C(Cn1c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4473 |
| logD: | 1.4473 |
| logSw: | -1.467 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.608 |
| InChI Key: | LUYDMZBFNPTBCX-UHFFFAOYSA-N |