N-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide
Chemical Structure Depiction of
N-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide
N-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide
Compound characteristics
| Compound ID: | S555-1721 |
| Compound Name: | N-[4-(3-methoxybenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide |
| Molecular Weight: | 402.47 |
| Molecular Formula: | C20 H22 N2 O5 S |
| Smiles: | COc1cccc(c1)S(N1CCOc2ccc(cc2C1)NC(C1CC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0454 |
| logD: | 3.0454 |
| logSw: | -3.5418 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.052 |
| InChI Key: | JPXYBBOKHULVSS-UHFFFAOYSA-N |