N-[4-(cyclopentanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea
Chemical Structure Depiction of
N-[4-(cyclopentanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea
N-[4-(cyclopentanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea
Compound characteristics
| Compound ID: | S555-0877 |
| Compound Name: | N-[4-(cyclopentanecarbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea |
| Molecular Weight: | 331.41 |
| Molecular Formula: | C18 H25 N3 O3 |
| Smiles: | CCNC(Nc1ccc2c(CN(CCO2)C(C2CCCC2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8269 |
| logD: | 2.8269 |
| logSw: | -3.1996 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.911 |
| InChI Key: | KKRPXQCDKSZYCW-UHFFFAOYSA-N |