N-ethyl-N'-[4-(phenylacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]urea
Chemical Structure Depiction of
N-ethyl-N'-[4-(phenylacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]urea
N-ethyl-N'-[4-(phenylacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]urea
Compound characteristics
| Compound ID: | S555-0933 |
| Compound Name: | N-ethyl-N'-[4-(phenylacetyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]urea |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C20 H23 N3 O3 |
| Smiles: | CCNC(Nc1ccc2c(CN(CCO2)C(Cc2ccccc2)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9593 |
| logD: | 2.9593 |
| logSw: | -3.363 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.826 |
| InChI Key: | PRQWEXYYUHXBQH-UHFFFAOYSA-N |