N-ethyl-N'-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)urea
Chemical Structure Depiction of
N-ethyl-N'-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)urea
N-ethyl-N'-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)urea
Compound characteristics
| Compound ID: | S555-0917 |
| Compound Name: | N-ethyl-N'-(4-propanoyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl)urea |
| Molecular Weight: | 291.35 |
| Molecular Formula: | C15 H21 N3 O3 |
| Smiles: | CCC(N1CCOc2ccc(cc2C1)NC(NCC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.892 |
| logD: | 1.892 |
| logSw: | -2.7624 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.097 |
| InChI Key: | KDCKWHWDARXXHT-UHFFFAOYSA-N |