N-(butan-2-yl)-N'-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]urea
Chemical Structure Depiction of
N-(butan-2-yl)-N'-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]urea
N-(butan-2-yl)-N'-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]urea
Compound characteristics
| Compound ID: | S896-0673 |
| Compound Name: | N-(butan-2-yl)-N'-[1-(2-cyclopentyl-5,6,8,9-tetrahydrooxepino[4,5-d]pyrimidin-4-yl)piperidin-4-yl]urea |
| Molecular Weight: | 415.58 |
| Molecular Formula: | C23 H37 N5 O2 |
| Smiles: | CCC(C)NC(NC1CCN(CC1)c1c2CCOCCc2nc(C2CCCC2)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9905 |
| logD: | 3.9195 |
| logSw: | -3.8936 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.336 |
| InChI Key: | MPBYKAWQPYATND-INIZCTEOSA-N |