N-[4-(phenylmethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide
Chemical Structure Depiction of
N-[4-(phenylmethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide
N-[4-(phenylmethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide
Compound characteristics
| Compound ID: | S555-1713 |
| Compound Name: | N-[4-(phenylmethanesulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]cyclopropanecarboxamide |
| Molecular Weight: | 386.47 |
| Molecular Formula: | C20 H22 N2 O4 S |
| Smiles: | C1CC1C(Nc1ccc2c(CN(CCO2)S(Cc2ccccc2)(=O)=O)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6829 |
| logD: | 2.6829 |
| logSw: | -3.2349 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.402 |
| InChI Key: | YJRVOKRASSAAOM-UHFFFAOYSA-N |