N-[4-(2,6-dimethoxypyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea
Chemical Structure Depiction of
N-[4-(2,6-dimethoxypyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea
N-[4-(2,6-dimethoxypyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea
Compound characteristics
| Compound ID: | S555-0837 |
| Compound Name: | N-[4-(2,6-dimethoxypyridine-3-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N'-ethylurea |
| Molecular Weight: | 400.43 |
| Molecular Formula: | C20 H24 N4 O5 |
| Smiles: | CCNC(Nc1ccc2c(CN(CCO2)C(c2ccc(nc2OC)OC)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.877 |
| logD: | 2.877 |
| logSw: | -3.3807 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.715 |
| InChI Key: | AUHPBWONIHNRMY-UHFFFAOYSA-N |