4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(3-methylbutyl)piperidine-1-carboxamide
Chemical Structure Depiction of
4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(3-methylbutyl)piperidine-1-carboxamide
4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(3-methylbutyl)piperidine-1-carboxamide
Compound characteristics
| Compound ID: | S897-0102 |
| Compound Name: | 4-[(2-ethyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)oxy]-N-(3-methylbutyl)piperidine-1-carboxamide |
| Molecular Weight: | 390.53 |
| Molecular Formula: | C21 H34 N4 O3 |
| Smiles: | CCc1nc2CCOCCc2c(n1)OC1CCN(CC1)C(NCCC(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4965 |
| logD: | 3.4965 |
| logSw: | -3.6012 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.385 |
| InChI Key: | WTWHKODXWKUZDC-UHFFFAOYSA-N |