N-ethyl-3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-methylprop-2-en-1-yl)propanamide
Chemical Structure Depiction of
N-ethyl-3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-methylprop-2-en-1-yl)propanamide
N-ethyl-3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-methylprop-2-en-1-yl)propanamide
Compound characteristics
| Compound ID: | S629-0974 |
| Compound Name: | N-ethyl-3-[4-(methanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]-N-(2-methylprop-2-en-1-yl)propanamide |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C19 H28 N2 O4 S |
| Smiles: | CCN(CC(C)=C)C(CCc1ccc2c(CN(CCO2)S(C)(=O)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6968 |
| logD: | 2.6968 |
| logSw: | -2.8784 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.338 |
| InChI Key: | IBXUVYKRTKAUAR-UHFFFAOYSA-N |