N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-3-methylbutanamide
Chemical Structure Depiction of
N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-3-methylbutanamide
N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-3-methylbutanamide
Compound characteristics
| Compound ID: | S896-0648 |
| Compound Name: | N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-3-methylbutanamide |
| Molecular Weight: | 400.56 |
| Molecular Formula: | C23 H36 N4 O2 |
| Smiles: | CC(C)CC(NC1CCN(CC1)c1c2CCOCCc2nc(C2CCCC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3971 |
| logD: | 4.3261 |
| logSw: | -4.0624 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.147 |
| InChI Key: | YOWXDNGRLPDYJQ-UHFFFAOYSA-N |