N-cyclopropyl-3-[4-(3-fluorobenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
N-cyclopropyl-3-[4-(3-fluorobenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
N-cyclopropyl-3-[4-(3-fluorobenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1889 |
| Compound Name: | N-cyclopropyl-3-[4-(3-fluorobenzene-1-sulfonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C21 H23 F N2 O4 S |
| Smiles: | C(Cc1ccc2c(CN(CCO2)S(c2cccc(c2)F)(=O)=O)c1)C(NC1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1019 |
| logD: | 3.1019 |
| logSw: | -3.5063 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.15 |
| InChI Key: | JWIOKCCIMYAEOZ-UHFFFAOYSA-N |