N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-N'-ethylurea
Chemical Structure Depiction of
N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-N'-ethylurea
N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-N'-ethylurea
Compound characteristics
| Compound ID: | S896-0668 |
| Compound Name: | N-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]-N'-ethylurea |
| Molecular Weight: | 387.52 |
| Molecular Formula: | C21 H33 N5 O2 |
| Smiles: | CCNC(NC1CCN(CC1)c1c2CCOCCc2nc(C2CCCC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2889 |
| logD: | 3.2179 |
| logSw: | -3.3947 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.52 |
| InChI Key: | CWHKRPCALMAZQP-UHFFFAOYSA-N |