N-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-ethylurea
Chemical Structure Depiction of
N-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-ethylurea
N-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-ethylurea
Compound characteristics
| Compound ID: | S555-0953 |
| Compound Name: | N-{4-[(benzyloxy)acetyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}-N'-ethylurea |
| Molecular Weight: | 383.45 |
| Molecular Formula: | C21 H25 N3 O4 |
| Smiles: | CCNC(Nc1ccc2c(CN(CCO2)C(COCc2ccccc2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5085 |
| logD: | 2.5085 |
| logSw: | -2.9619 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.26 |
| InChI Key: | VZKLGUHXBJJAAH-UHFFFAOYSA-N |