N-[2-ethyl-3-oxo-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2,6-dimethoxybenzamide
Chemical Structure Depiction of
N-[2-ethyl-3-oxo-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2,6-dimethoxybenzamide
N-[2-ethyl-3-oxo-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2,6-dimethoxybenzamide
Compound characteristics
| Compound ID: | V003-5656 |
| Compound Name: | N-[2-ethyl-3-oxo-4-(1,2,3,4-tetrahydronaphthalen-1-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-2,6-dimethoxybenzamide |
| Molecular Weight: | 500.59 |
| Molecular Formula: | C30 H32 N2 O5 |
| Smiles: | CCC1C(N(Cc2cc(ccc2O1)NC(c1c(cccc1OC)OC)=O)C1CCCc2ccccc12)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2771 |
| logD: | 5.218 |
| logSw: | -5.1431 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.708 |
| InChI Key: | IRZLERBYOKXDQO-UHFFFAOYSA-N |