N-ethyl-N'-{4-[3-(4-methoxyphenyl)propanoyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}urea
Chemical Structure Depiction of
N-ethyl-N'-{4-[3-(4-methoxyphenyl)propanoyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}urea
N-ethyl-N'-{4-[3-(4-methoxyphenyl)propanoyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}urea
Compound characteristics
| Compound ID: | S555-0863 |
| Compound Name: | N-ethyl-N'-{4-[3-(4-methoxyphenyl)propanoyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}urea |
| Molecular Weight: | 397.47 |
| Molecular Formula: | C22 H27 N3 O4 |
| Smiles: | CCNC(Nc1ccc2c(CN(CCO2)C(CCc2ccc(cc2)OC)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2504 |
| logD: | 3.2504 |
| logSw: | -3.3803 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.37 |
| InChI Key: | NXYGXUOWHUDBMT-UHFFFAOYSA-N |